--- 
1: 
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: https://www.ebi.ac.uk/chembldb/compound/inspect/
    base_id_url_available: 1
    description: A database of bioactive drug-like small molecules and bioactivities abstracted from the scientific literature.
    name: chembl
    name_label: ChEMBL
    name_long: ChEMBL
    src_URL: https://www.ebi.ac.uk/chembl/
    src_details: Standard InChIs and Keys provided on ftp site for each release.
    src_id: 1
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: &1 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: CHEMBL121
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: &2 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 1
            p: 0
            s: 1
            t: 1
        src_compound_id: CHEMBL121106
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: &3 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 1
            p: 0
            s: 1
            t: 1
        src_compound_id: CHEMBL333304
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.drugbank.ca/drugs/
    base_id_url_available: 1
    description: A database that combines drug (i.e. chemical, pharmacological and pharmaceutical) data with drug target (i.e. sequence, structure, and pathway) information.
    name: drugbank
    name_label: DrugBank
    name_long: DrugBank
    src_URL: http://drugbank.ca/
    src_details: Standard InChIs and Keys provided within sd file on ftp site for each release.
    src_id: 2
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: DB00412
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.ebi.ac.uk/pdbe-srv/pdbechem/chemicalCompound/show/
    base_id_url_available: 1
    description: The European resource for the collection, organisation and dissemination of data on biological macromolecular structures, including structures of small molecule ligands for proteins.
    name: pdb
    name_label: PDBe
    name_long: PDBe (Protein Data Bank Europe)
    src_URL: http://www.ebi.ac.uk/pdbe/
    src_details: Standard InChIs and Keys provided by direct querying of Oracle DB.
    src_id: 3
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: BRL
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: RGZ
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.guidetopharmacology.org/GRAC/LigandDisplayForward?ligandId=
    base_id_url_available: 1
    description: The IUPHAR (International Union of Basic and Clinical Pharmacology)/BPS (British Pharmacological Society) Guide to PHARMACOLOGY database contains structures of small molecule ligands, peptides and antibodies, with their affinities at protein targets.
    name: gtopdb
    name_label: Guide to Pharmacology
    name_long: Guide to Pharmacology
    src_URL: http://www.guidetopharmacology.org
    src_details: Standard InChIs and Keys available for download at http://www.guidetopharmacology.org/download.jsp
    src_id: 4
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 1056
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://pubchem.ncbi.nlm.nih.gov/substance/
    base_id_url_available: 1
    description: "A subset of the PubChem DB: from the original depositor 'drugs of the future' (Prous)."
    name: pubchem_dotf
    name_label: "PubChem: Drugs of the Future "
    name_long: PubChem ('Drugs of the Future' subset)
    src_URL: http://pubchem.ncbi.nlm.nih.gov/sources/sources.cgi
    src_details: Mol files for SIDs downloaded manually, via PubChem interface, and Standard InChIs and Keys generated by InChI software. SIDs used as identifiers.
    src_id: 5
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 50086904
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI%3A
    base_id_url_available: 1
    description: ChEBI is a freely available dictionary of molecular entities focused on 'small' chemical compounds
    name: chebi
    name_label: ChEBI
    name_long: ChEBI (Chemical Entities of Biological Interest).
    src_URL: http://www.ebi.ac.uk/chebi/downloadsForward.do
    src_details: Std InChis (but no keys) provided on ftp site. Keys generated by UniChem. 'all star' compounds downloaded
    src_id: 7
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 50122
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: 50125
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: 50123
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://zinc15.docking.org/substances/
    base_id_url_available: 1
    description: A free database of commercially-available compounds for virtual screening, provided by the Shoichet Laboratory in the Department of Pharmaceutical Chemistry at the University of California, San Francisco (UCSF).  [Irwin and Shoichet, J. Chem. Inf. Model. 2005;45(1):177-82]
    name: zinc
    name_label: ZINC
    name_long: ZINC
    src_URL: http://zinc15.docking.org
    src_details: novirtual subset of ZINC15, as a file containing inchis and keys from http://files.docking.org/export/unichem/
    src_id: 9
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: ZINC000000968328
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: ZINC000000968330
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: https://www.emolecules.com/cgi-bin/more?vid=
    base_id_url_available: 1
    description: A free chemical structure search engine containing millions of public domain structures. Pricing, availabilities, and vendor information requires an eMolecules Plus subscription.
    name: emolecules
    name_label: eMolecules
    name_long: eMolecules
    src_URL: https://www.emolecules.com/
    src_details: Downloaded as an SD file from source, Converted to InChI and INChIKeys by UniChem
    src_id: 10
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 902429
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-FIBGUPNXSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3
        assignment: 1
        aux_src: ~
        match_compare: &4 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 26948345
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.ebi.ac.uk/gxa/query?conditionQuery=
    base_id_url_available: 1
    description: The Gene Expression Atlas is a semantically enriched database of meta-analysis based summary statistics over a curated subset of ArrayExpress Archive, servicing queries for condition-specific gene expression patterns as well as broader exploratory searches for biologically interesting genes/samples.
    name: atlas
    name_label: Atlas
    name_long: Gene Expression Atlas
    src_URL: http://www.ebi.ac.uk/gxa/home
    src_details: Currently extracted from compound names.
    src_id: 12
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: rosiglitazone
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://fdasis.nlm.nih.gov/srs/ProxyServlet?mergeData=true&objectHandle=DBMaint&APPLICATION_NAME=fdasrs&actionHandle=default&nextPage=jsp/srs/ResultScreen.jsp&TXTSUPERLISTID=
    base_id_url_available: 1
    description: "The primary goal of the FDA/USP Substance Registration System (SRS) is to unambiguously define all substances present in regulated products. Once a substance has been defined, the SRS assigns a strong identifier that is permanently associated with the substance: a UNII (Unique Ingredient Identifier). This is a a non-proprietary, free, unique, unambiguous, nonsemantic, alphanumeric identifier based on a substances molecular structure and/or descriptive information."
    name: fdasrs
    name_label: FDA SRS
    name_long: FDA/USP Substance Registration System (SRS)
    src_URL: http://fdasis.nlm.nih.gov/srs/srs.jsp
    src_details: Download of InChIKeys in file UNII Data  from http://fdasis.nlm.nih.gov/srs/jsp/srs/uniiListDownload.jsp
    src_id: 14
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: 6L2K7RBQ5H
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: 3U8PBH2BON
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: https://www.surechembl.org/chemical/
    base_id_url_available: 1
    description: SureChEMBL automatically extracts chemistry from the full text of all major patent authorities. Compounds are derived from either chemical names found in text or in chemical depictions. All SureChEMBL compounds are included, except those failing UniChem loading rules.
    name: surechembl
    name_label: SureChEMBL
    name_long: SureChEMBL
    src_URL: https://www.surechembl.org/search/
    src_details: Standard InChIs and InChIKeys provided by a direct feed from the SureChEMBL database
    src_id: 15
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: SCHEMBL5169
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: SCHEMBL2355017
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: SCHEMBL11957687
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.pharmgkb.org/drug/
    base_id_url_available: 1
    description: PharmGKB (Pharmacogenomics Knowledgebase) is a comprehensive resource that curates knowledge about the impact of genetic variation on drug response for clinicians and researchers.
    name: pharmgkb
    name_label: PharmGKB
    name_long: PharmGKB
    src_URL: http://www.pharmgkb.org
    src_details: drugs.zip file from from download site https://www.pharmgkb.org/downloads/. Smiles contained in this file Converted to Std InChIs internally
    src_id: 17
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: PA451283
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.hmdb.ca/metabolites/
    base_id_url_available: 1
    description: "The Human Metabolome Database (HMDB) is a freely available electronic database containing detailed information about small molecule metabolites found in the human body. It is intended to be used for applications in metabolomics, clinical chemistry, biomarker discovery and general education. The database is designed to contain or link three kinds of data: 1) chemical data, 2) clinical data, and 3) molecular biology/biochemistry data"
    name: hmdb
    name_label: Human Metabolome Database
    name_long: Human Metabolome Database (HMDB)
    src_URL: http://www.hmdb.ca
    src_details: SD file download from source, converted to InChIs within UniChem
    src_id: 18
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: HMDB0005031
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 1
    base_id_url: http://www.selleckchem.com/products/
    base_id_url_available: 1
    description: Selleck Chemicals is a supplier of biochemical products, including over 1,000 inhibitor products
    name: selleck
    name_label: Selleck
    name_long: Selleck
    src_URL: http://www.selleckchem.com
    src_details: SD file provided by email. InChIs generated by UniChem
    src_id: 20
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: Rosiglitazone-Avandia.html
        match_compare: *1
        src_compound_id: Rosiglitazone-Avandia
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://pubchem.ncbi.nlm.nih.gov/substance/
    base_id_url_available: 1
    description: "A subset of the PubChem DB: from the original depositor 'Thomson Pharma'."
    name: pubchem_tpharma
    name_label: "PubChem: Thomson Pharma "
    name_long: PubChem ('Thomson Pharma' subset)
    src_URL: http://www.thomson-pharma.com/
    src_details: Mol files for SIDs downloaded manually, via PubChem interface, and Standard InChIs and Keys generated by InChI software. SIDs used as identifiers.
    src_id: 21
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-KFFMWUEUSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3,2D,3D,4D,5D,6D,7D,8D,9D,10D2,11D2,12D2,15D/hD
        assignment: 1
        aux_src: ~
        match_compare: &5 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3,2D,3D,4D,5D,6D,7D,8D,9D,10D2,11D2,12D2,15D/hD
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575502
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-RWFJLFJASA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15D
        assignment: 1
        aux_src: ~
        match_compare: &6 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15D
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575503
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 14876617
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HVRMQOCCSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12+2
        assignment: 1
        aux_src: ~
        match_compare: &7 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12+2
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 15748562
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-ZXSOXEPXSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12T,15T
        assignment: 1
        aux_src: ~
        match_compare: &8 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12T,15T
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 15698974
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-FIBGUPNXSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3
        assignment: 1
        aux_src: ~
        match_compare: *4
        src_compound_id: 57575691
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-KDWZCNHSSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i5D,6D,7D,8D
        assignment: 1
        aux_src: ~
        match_compare: &9 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i5D,6D,7D,8D
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575505
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-PZFLKRBQSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i3T,4T
        assignment: 1
        aux_src: ~
        match_compare: &10 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i3T,4T
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 15673811
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-BBSCNJGJSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15T
        assignment: 1
        aux_src: ~
        match_compare: &11 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15T
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 15598491
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-MKQHWYKPSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i10D2,11D2
        assignment: 1
        aux_src: ~
        match_compare: &12 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i10D2,11D2
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575690
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-XUWBISKJSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12D2
        assignment: 1
        aux_src: ~
        match_compare: &13 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12D2
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575501
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-CKSJCSQYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i2D,3D,4D,9D
        assignment: 1
        aux_src: ~
        match_compare: &14 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i2D,3D,4D,9D
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575692
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: 15002587
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-YLBMHPPPSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15D/hD
        assignment: 1
        aux_src: ~
        match_compare: &15 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15D/hD
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 57575504
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://pubchem.ncbi.nlm.nih.gov/compound/
    base_id_url_available: 1
    description: A database of normalized PubChem compounds (CIDs) from the PubChem Database.
    name: pubchem
    name_label: PubChem
    name_long: PubChem Compounds
    src_URL: http://pubchem.ncbi.nlm.nih.gov
    src_details: Standard InChIs and Keys provided on ftp site.
    src_id: 22
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-M
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p-1
        assignment: 1
        aux_src: ~
        match_compare: 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p-1
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 0
            p: 1
            s: 0
            t: 0
        src_compound_id: 127054492
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-KFFMWUEUSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3,2D,3D,4D,5D,6D,7D,8D,9D,10D2,11D2,12D2,15D/hD
        assignment: 1
        aux_src: ~
        match_compare: *5
        src_compound_id: 25224922
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-RWFJLFJASA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15D
        assignment: 1
        aux_src: ~
        match_compare: *6
        src_compound_id: 25224923
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 77999
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HVRMQOCCSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12+2
        assignment: 1
        aux_src: ~
        match_compare: *7
        src_compound_id: 10713477
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-ZXSOXEPXSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12T,15T
        assignment: 1
        aux_src: ~
        match_compare: *8
        src_compound_id: 10666307
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-FIBGUPNXSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1D3
        assignment: 1
        aux_src: ~
        match_compare: *4
        src_compound_id: 25225106
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-O
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p+1
        assignment: 1
        aux_src: ~
        match_compare: 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p+1
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 0
            p: 1
            s: 0
            t: 0
        src_compound_id: 23560857
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-KDWZCNHSSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i5D,6D,7D,8D
        assignment: 1
        aux_src: ~
        match_compare: *9
        src_compound_id: 25224925
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-PZFLKRBQSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i3T,4T
        assignment: 1
        aux_src: ~
        match_compare: *10
        src_compound_id: 10642333
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-BBSCNJGJSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15T
        assignment: 1
        aux_src: ~
        match_compare: *11
        src_compound_id: 10570460
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: 445655
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HRBFZRADSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15+2
        assignment: 1
        aux_src: ~
        match_compare: &16 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15+2
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 102170992
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-MKQHWYKPSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i10D2,11D2
        assignment: 1
        aux_src: ~
        match_compare: *12
        src_compound_id: 25225105
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-KQORAOOSSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1+1D3
        assignment: 1
        aux_src: ~
        match_compare: 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i1+1D3
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 1
            m: 0
            p: 0
            s: 0
            t: 0
        src_compound_id: 76973119
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-O
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p+1/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p+1/t15-/m0/s1
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 1
            p: 1
            s: 1
            t: 1
        src_compound_id: 29010895
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-XUWBISKJSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i12D2
        assignment: 1
        aux_src: ~
        match_compare: *13
        src_compound_id: 25224921
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-O
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p+1/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: 
          - 
            C: 0
            Matching_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p+1/t15-/m1/s1
            Matching_Query_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
            b: 0
            i: 0
            m: 1
            p: 1
            s: 1
            t: 1
        src_compound_id: 29010896
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-CKSJCSQYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i2D,3D,4D,9D
        assignment: 1
        aux_src: ~
        match_compare: *14
        src_compound_id: 25225107
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: 10021239
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-YLBMHPPPSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15D/hD
        assignment: 1
        aux_src: ~
        match_compare: *15
        src_compound_id: 25224924
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: https://mcule.com/
    base_id_url_available: 1
    description: An online drug discovery platform with virtual screening and molecular modelling services.
    name: mcule
    name_label: Mcule
    name_long: Mcule
    src_URL: https://mcule.com
    src_details: Standard InChIs and Keys provided by email.
    src_id: 23
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: MCULE-8293284864
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: MCULE-1960701346
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://identifiers.org/lincs.smallmolecule/
    base_id_url_available: 1
    description: The LINCS DCIC facilitates and standardized the information relevant to LINCS assays as described in http://www.lincsproject.org/data/data-standards/
    name: lincs
    name_label: LINCS
    name_long: Library of Integrated Network-based Cellular Signatures
    src_URL: http://www.lincsproject.org/
    src_details: Standard InChIs and Keys downloadable fromhttp://lincs-dcic.org/metadata/SmallMolecules
    src_id: 25
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: LSM-1949
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://actor.epa.gov/actor/chemical.xhtml?casrn=
    base_id_url_available: 1
    description: ACToR (Aggregated Computational Toxicology Resource)
    name: actor
    name_label: ACToR
    name_long: ACToR
    src_URL: https://actor.epa.gov
    src_details: Standard InChIs and Keys generated from SMILES from DB download
    src_id: 26
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 122320-73-4
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=
    base_id_url_available: 1
    description: " Nakkaji (The Japan Chemical Substance Dictionary) is an organic compound dictionary database prepared by the Japan Science and Technology Agency (JST)."
    name: nikkaji
    name_label: Nikkaji
    name_long: Nikkaji
    src_URL: http://jglobal.jst.go.jp/en/
    src_details: Standard InChIs and Keys available from ftp site
    src_id: 29
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: J620.770G
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HNNXBMFYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m0/s1
        assignment: 1
        aux_src: ~
        match_compare: *2
        src_compound_id: J1.242.355A
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-HRBFZRADSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/i15+2
        assignment: 1
        aux_src: ~
        match_compare: *16
        src_compound_id: J2.811.565B
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-OAHLLOKOSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/t15-/m1/s1
        assignment: 1
        aux_src: ~
        match_compare: *3
        src_compound_id: J621.160G
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: https://comptox.epa.gov/dashboard/
    base_id_url_available: 1
    description: The foundation of chemical safety testing relies on chemistry information such as high-quality chemical structures and physicochemical properties. This information is used by scientists to predict the potential health risks of chemicals.The CompTox Dashboard is part of a suite of dashboards developed by EPA to help evaluate the safety of chemicals. It provides access to a variety of data and information on over 700,000 chemicals currently in use and of interest to environmental researchers. Within the CompTox Dashboard, users can access chemical structures, experimental and predicted physicochemical and toxicity data, and additional links to relevant websites and applications. It maps curated physicochemical property data associated with chemical substances to their corresponding chemical structures
    name: comptox
    name_label: EPA CompTox Dashboard
    name_long: EPA (Environmental Protection Agency) CompTox Dashboard
    src_URL: https://comptox.epa.gov/dashboard/
    src_details: Standard InChIs and Keys obtained from download page
    src_id: 32
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: DTXSID7037131
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://drugcentral.org/drugcard/
    base_id_url_available: 1
    description: DrugCentral is an online drug information resource created and maintained by Division of Translational Informatics at University of New Mexico, providing information on active ingredients chemical entities, pharmaceutical products, drug mode of action, indications, pharmacologic action
    name: drugcentral
    name_label: DrugCentral
    name_long: DrugCentral
    src_URL: http://drugcentral.org
    src_details: Standard InChIs and Keys available as a download.
    src_id: 34
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 2405
  - 
    Full Query InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
    Full Query InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
    aux_for_url: 0
    base_id_url: http://www.brenda-enzymes.org/ligand.php?brenda_ligand_id=
    base_id_url_available: 1
    description: A comprehensive Enzyme Information system containing enzyme functional data extracted directly from the primary literature.
    name: brenda
    name_label: Brenda
    name_long: Brenda
    src_URL: http://www.brenda-enzymes.org/index.php
    src_details: Standard InChIKeys available as a download
    src_id: 37
    src_matches: 
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 3404
      - 
        B: 0
        CpdId_InChIKey: YASAKCUCGLMORW-UHFFFAOYSA-N
        Full_CpdId_InChI: InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
        assignment: 1
        aux_src: ~
        match_compare: *1
        src_compound_id: 83445