CHEBI:17807 - 3-(3,4-dihydroxyphenyl)lactic acid

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ChEBI Name 3-(3,4-dihydroxyphenyl)lactic acid
ChEBI ID CHEBI:17807
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1423, CHEBI:11720, CHEBI:19925
Supplier Information
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Formula C9H10O5
Net Charge 0
Average Mass 198.17270
Monoisotopic Mass 198.053
InChI InChI=1S/C9H10O5/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-3,8,10-12H,4H2,(H,13,14)
InChIKey PAFLSMZLRSPALU-UHFFFAOYSA-N
SMILES OC(Cc1ccc(O)c(O)c1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:17807) has functional parent rac-lactic acid (CHEBI:28358)
3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:17807) is a 2-hydroxy monocarboxylic acid (CHEBI:49302)
3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:17807) is a catechols (CHEBI:33566)
3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:17807) is conjugate acid of 3-(3,4-dihydroxyphenyl)lactate (CHEBI:58279)
Incoming (2R)-3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:71572) is a 3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:17807)
3-(3,4-dihydroxyphenyl)lactate (CHEBI:58279) is conjugate base of 3-(3,4-dihydroxyphenyl)lactic acid (CHEBI:17807)
IUPAC Name
3-(3,4-dihydroxyphenyl)-2-hydroxypropanoic acid
Synonym Source
3-(3,4-Dihydroxyphenyl)lactate KEGG COMPOUND
Manual Xref Database
C01207 KEGG COMPOUND
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Last Modified
23 October 2015