3-hydroxy-3-(4-methoxyphenyl)propanal (CHEBI:193736)

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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	3-hydroxy-3-(4-methoxyphenyl)propanal

ChEBI ID	CHEBI:193736

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H12O3

Net Charge

Average Mass

180.203

Monoisotopic Mass

180.07864

InChI

InChI=1S/C10H12O3/c1-13-9-4-2-8(3-5-9)10(12)6-7-11/h2-5,7,10,12H,6H2,1H3

InChIKey

CPFXFBKDRFLCQW-UHFFFAOYSA-N

SMILES

OC(C1=CC=C(OC)C=C1)CC=O

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

ChEBI Ontology
Outgoing	3-hydroxy-3-(4-methoxyphenyl)propanal (CHEBI:193736) is a methoxybenzenes (CHEBI:51683)

IUPAC Name

3-hydroxy-3-(4-methoxyphenyl)propanal