CHEBI:193226 - 2-(2,5-dihydroxy-4-methoxyphenyl)acetic acid

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ChEBI Name 2-(2,5-dihydroxy-4-methoxyphenyl)acetic acid
ChEBI ID CHEBI:193226
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H10O5
Net Charge 0
Average Mass 198.174
Monoisotopic Mass 198.05282
InChI InChI=1S/C9H10O5/c1-14-8-4-6(10)5(2-7(8)11)3-9(12)13/h2,4,10-11H,3H2,1H3,(H,12,13)
InChIKey PCJSSDGVSARPLU-UHFFFAOYSA-N
SMILES O(C1=C(O)C=C(CC(O)=O)C(O)=C1)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in feces (BTO:0000440). See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-(2,5-dihydroxy-4-methoxyphenyl)acetic acid (CHEBI:193226) is a phenols (CHEBI:33853)
2-(2,5-dihydroxy-4-methoxyphenyl)acetic acid (CHEBI:193226) is a phenylacetic acids (CHEBI:25978)
IUPAC Name
2-(2,5-dihydroxy-4-methoxyphenyl)acetic acid
Manual Xref Database
16219250 ChemSpider
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