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Record Information
Version1.0
StatusDetected and Quantified
Creation Date2020-12-10 18:50:35 UTC
Update Date2024-09-27 20:36:14 UTC
Metabolite IDMMDBc0000589
Metabolite Identification
Common NameIndole-3-propionic acid
Description
Structure
Synonyms
Molecular FormulaC11H11NO2
Average Mass189.2105
Monoisotopic Mass189.078978601
IUPAC Name3-(1H-indol-3-yl)propanoic acid
Traditional Nameindolylpropionic acid
CAS Registry NumberNot Available
SMILES
OC(=O)CCC1=CNC2=C1C=CC=C2
InChI Identifier
InChI=1S/C11H11NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6H2,(H,13,14)
InChI KeyGOLXRNDWAUTYKT-UHFFFAOYSA-N