3-(3-hydroxyphenyl)oxirane-2-carboxylic acid (CHEBI:193983)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	3-(3-hydroxyphenyl)oxirane-2-carboxylic acid

ChEBI ID	CHEBI:193983

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H8O4

Net Charge

Average Mass

180.159

Monoisotopic Mass

180.04226

InChI

InChI=1S/C9H8O4/c10-6-3-1-2-5(4-6)7-8(13-7)9(11)12/h1-4,7-8,10H,(H,11,12)

InChIKey

QNJOLQNPVQFSBN-UHFFFAOYSA-N

SMILES

O1C(C1C(O)=O)C2=CC(O)=CC=C2

Metabolite of Species	Details
mock community culture	Found in Whole Organism (NCIT:C13413). See: MetaboLights Study

ChEBI Ontology
Outgoing	3-(3-hydroxyphenyl)oxirane-2-carboxylic acid (CHEBI:193983) is a phenols (CHEBI:33853)

IUPAC Name

3-(3-hydroxyphenyl)oxirane-2-carboxylic acid