CHEBI:90909 - deoxyviolaceinic acid

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ChEBI Name deoxyviolaceinic acid ChEBI ID CHEBI:90909 Definition A pyrrolecarboxylic acid that is pyrrole-2-carboxylic acid which is substituted at position 3 by a 3-hydroxyindol-3-yl group at at position 5 by an indol-3-yl group. Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C21H15N3O3 Net Charge 0 Average Mass 357.363 Monoisotopic Mass 357.11134 InChI InChI=1S/C21H15N3O3/c25-20-18(12-6-2-4-8-16(12)24-20)13-9-17(23-19(13)21(26)27)14-10-22-15-7-3-1-5-11(14)15/h1-10,22-25H,(H,26,27) InChIKey YNGCGCMGWQFYIK-UHFFFAOYSA-N SMILES OC=1NC=2C(C1C=3C=C(NC3C(=O)O)C=4C=5C(NC4)=CC=CC5)=CC=CC2 Metabolite of Species Details Chromobacterium violaceum (NCBI:txid536) See: PubMed Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing deoxyviolaceinic acid (CHEBI:90909) has role bacterial metabolite (CHEBI:76969) deoxyviolaceinic acid (CHEBI:90909) is a hydroxyindoles (CHEBI:84729) deoxyviolaceinic acid (CHEBI:90909) is a monocarboxylic acid (CHEBI:25384) deoxyviolaceinic acid (CHEBI:90909) is a pyrrolecarboxylic acid (CHEBI:26454) deoxyviolaceinic acid (CHEBI:90909) is conjugate acid of deoxyviolaceinate (CHEBI:90910) Incoming deoxyviolaceinate (CHEBI:90910) is conjugate base of deoxyviolaceinic acid (CHEBI:90909) IUPAC Name 3-(2-hydroxy-1H-indol-3-yl)-5-(1H-indol-3-yl)-1H-pyrrole-2-carboxylic acid Manual Xref Database CPD-14323 MetaCyc View more database links Citation Type Source 21779844 PubMed citation Europe PMC Last Modified 12 July 2016