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CHEBI:193544 - Desmethyldeschlorobenzoyl Indomethacin

ChEBI IDCHEBI:193544
ChEBI NameDesmethyldeschlorobenzoyl Indomethacin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H11NO3
Net Charge0
Average Mass205.213
Monoisotopic Mass205.07389
SMILESCc1nc2ccc(O)cc2c1CC(=O)O
InChIInChI=1S/C11H11NO3/c1-6-8(5-11(14)15)9-4-7(13)2-3-10(9)12-6/h2-4,12-13H,5H2,1H3,(H,14,15)
InChIKeyFDADMESSMPJUJC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Desmethyldeschlorobenzoyl Indomethacin (CHEBI:193544) is a indole-3-acetic acids (CHEBI:24803)
IUPAC Name 
2-(5-hydroxy-2-methyl-1H-indol-3-yl)acetic acid
Manual XrefsDatabases
9485220ChemSpider
Registry NumbersSources
CAS:50995-53-4ChemIDplus