dihydroferulic acid (CHEBI:86612)

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ChEBI Name	dihydroferulic acid

ChEBI ID	CHEBI:86612

Definition	A monocarboxylic acid that is propanoic acid in which one of the hydrogens at position 3 has been replaced by a 4-hydroxy-3-methoxyphenyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C10H12O4

Net Charge

Average Mass

196.200

Monoisotopic Mass

196.07356

InChI

InChI=1S/C10H12O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2,4,6,11H,3,5H2,1H3,(H,12,13)

InChIKey

BOLQJTPHPSDZHR-UHFFFAOYSA-N

SMILES

C=1(C=C(C(=CC1)O)OC)CCC(=O)O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	See: PubMed
Bulbophyllum vaginatum (NCBI:txid1138424)	See: PubMed
Gypsophila paniculata (NCBI:txid235358)	See: PubMed
Pseudostellaria heterophylla (NCBI:txid418402)	Found in root (BTO:0001188). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in blood See: PubMed

Roles Classification
Chemical Role(s):	antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides. Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

ChEBI Ontology
Outgoing	dihydroferulic acid (CHEBI:86612) has functional parent propionic acid (CHEBI:30768) dihydroferulic acid (CHEBI:86612) has role antioxidant (CHEBI:22586) dihydroferulic acid (CHEBI:86612) has role human xenobiotic metabolite (CHEBI:76967) dihydroferulic acid (CHEBI:86612) has role mouse metabolite (CHEBI:75771) dihydroferulic acid (CHEBI:86612) has role plant metabolite (CHEBI:76924) dihydroferulic acid (CHEBI:86612) is a guaiacols (CHEBI:134251) dihydroferulic acid (CHEBI:86612) is a monocarboxylic acid (CHEBI:25384) dihydroferulic acid (CHEBI:86612) is a phenylpropanoid (CHEBI:26004) dihydroferulic acid (CHEBI:86612) is conjugate acid of dihydroferulate (CHEBI:133751)

Incoming	vanilloylacetic acid (CHEBI:142914) has functional parent dihydroferulic acid (CHEBI:86612) dihydroferulate (CHEBI:133751) is conjugate base of dihydroferulic acid (CHEBI:86612)

IUPAC Name

3-(4-hydroxy-3-methoxyphenyl)propanoic acid

Synonyms	Sources
3-(4-hydroxy-3-methoxyphenyl)propionic acid	ChemIDplus
dihydroconiferylic acid	ChemIDplus

Last Modified

15 January 2019