(S)-mandelic acid (CHEBI:32800)

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ChEBI Name	(S)-mandelic acid

ChEBI ID	CHEBI:32800

ChEBI ASCII Name	(S)-mandelic acid

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

Secondary ChEBI IDs	CHEBI:45767, CHEBI:18787, CHEBI:424

Supplier Information

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Formula

C8H8O3

Net Charge

Average Mass

152.14730

Monoisotopic Mass

152.04734

InChI

InChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)/t7-/m0/s1

InChIKey

IWYDHOAUDWTVEP-ZETCQYMHSA-N

SMILES

O[C@H](C(O)=O)c1ccccc1

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. (via mandelic acid ) human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. (via mandelic acid )

ChEBI Ontology
Outgoing	(S)-mandelic acid (CHEBI:32800) is a (2S)-2-hydroxy monocarboxylic acid (CHEBI:17375) (S)-mandelic acid (CHEBI:32800) is a mandelic acid (CHEBI:35825) (S)-mandelic acid (CHEBI:32800) is conjugate acid of (S)-mandelate (CHEBI:17756) (S)-mandelic acid (CHEBI:32800) is enantiomer of (R)-mandelic acid (CHEBI:17656)

Incoming	(S)-mandelate (CHEBI:17756) is conjugate base of (S)-mandelic acid (CHEBI:32800) (R)-mandelic acid (CHEBI:17656) is enantiomer of (S)-mandelic acid (CHEBI:32800)

IUPAC Name

(2S)-hydroxy(phenyl)acetic acid

Synonyms	Sources
(S)-2-Hydroxy-2-phenylacetic acid	KEGG COMPOUND
(S)-α-hydroxybenzeneacetic acid	ChemIDplus
(S)-Mandelic acid	KEGG COMPOUND
(S)-MANDELIC ACID	PDBeChem
(S)-Mandelsäure	ChEBI
L-mandelic acid	ChemIDplus

Last Modified

04 May 2018