CHEBI:173472 - Hydroxymethyl indol-3-yl ketone

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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 Hydroxymethyl indol-3-yl ketone
ChEBI ID CHEBI:173472
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H9NO2
Net Charge 0
Average Mass 175.187
Monoisotopic Mass 175.06333
InChI InChI=1S/C10H9NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-5,11-12H,6H2
InChIKey IBLZDDPFMAFWKP-UHFFFAOYSA-N
SMILES O=C(C=1C=2C(NC1)=CC=CC2)CO
ChEBI Ontology
Outgoing Hydroxymethyl indol-3-yl ketone (CHEBI:173472) is a indoles (CHEBI:24828)
IUPAC Name
2-hydroxy-1-(1H-indol-3-yl)ethanone
Manual Xrefs Databases
173681 ChemSpider
HMDB0038628 HMDB
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Registry Number Type Source
2400-51-3 CAS Registry Number ChemIDplus