3-(3,4-dimethoxyphenyl)prop-2-enoic acid (CHEBI:193396)

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CHEBI:193396 - 3-(3,4-dimethoxyphenyl)prop-2-enoic acid

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ChEBI ID	CHEBI:193396
ChEBI Name	3-(3,4-dimethoxyphenyl)prop-2-enoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C11H12O4
Net Charge	0
Average Mass	208.213
Monoisotopic Mass	208.07356
SMILES	COc1ccc(C=CC(=O)O)cc1OC
InChI	InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)
InChIKey	HJBWJAPEBGSQPR-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	feces (BTO:0000440)	MetaboLights (MTBLS5335)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	3-(3,4-dimethoxyphenyl)prop-2-enoic acid (CHEBI:193396) is a hydroxycinnamic acid (CHEBI:24689)

IUPAC Name
3-(3,4-dimethoxyphenyl)prop-2-enoic acid

Manual Xrefs	Databases
15967	ChemSpider