CHEBI:183039 - alpha-Methoxy-1H-indole-3-propanoic acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name alpha-Methoxy-1H-indole-3-propanoic acid
ChEBI ID CHEBI:183039
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H13NO3
Net Charge 0
Average Mass 219.240
Monoisotopic Mass 219.08954
InChI InChI=1S/C12H13NO3/c1-16-11(12(14)15)6-8-7-13-10-5-3-2-4-9(8)10/h2-5,7,11,13H,6H2,1H3,(H,14,15)
InChIKey WTRLCCDSRUPILA-UHFFFAOYSA-N
SMILES O(C(CC=1C=2C(NC1)=CC=CC2)C(O)=O)C
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) Found in Esophagus (BTO:0000959). See: MetaboLights Study
ChEBI Ontology
Outgoing alpha-Methoxy-1H-indole-3-propanoic acid (CHEBI:183039) is a indoles (CHEBI:24828)
IUPAC Name
3-(1H-indol-3-yl)-2-methoxypropanoic acid
Manual Xrefs Databases
35014550 ChemSpider
HMDB0038339 HMDB
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