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CHEBI:195236 - GayathriK_2023_C_1

Default Structure
ChEBI IDCHEBI:195236
ChEBI NameGayathriK_2023_C_1
Stars
DefinitionNovel Bioactive compund for pancreatic cancer
Last Modified22 August 2023
Submittergayathri30
DownloadsMolfile
FormulaC19H13ClN2O
Net Charge0
Average Mass320.779
Monoisotopic Mass320.07164
SMILES[Cl:1][c:2]1[n:3][c:4]2[c:5]([H:24])[c:6]([H:25])[c:7]([H:26])[c:8]([H:27])[c:9]2[c:10]([H:28])[c:11]1[C:12]([O:13][c:14]1[c:15]([H:31])[c:16]([H:32])[c:17]([H:33])[c:18]2[c:19]([H:34])[c:20]([H:35])[c:21]([H:36])[n:22][c:23]12)([H:29])[H:30]
InChIInChI=1S/C19H13ClN2O/c20-19-15(11-14-5-1-2-8-16(14)22-19)12-23-17-9-3-6-13-7-4-10-21-18(13)17/h1-11H,12H2
InChIKeyVBZFYMKLNNCELM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (NP_003813.1)
ChEBI Ontology
Outgoing Relation(s)
GayathriK_2023_C_1 (CHEBI:195236) is a organic molecular entity (CHEBI:50860)
Synonym  Source
GayathriK C1SUBMITTER