CHEBI:17656 - (R)-mandelic acid

ChEBI IDCHEBI:17656
ChEBI Name(R)-mandelic acid
Stars
ASCII Name(R)-mandelic acid
DefinitionThe (R)-enantiomer of mandelic acid.
Secondary ChEBI IDsCHEBI:344, CHEBI:18689, CHEBI:45338
Last Modified6 February 2014
DownloadsMolfile
FormulaC8H8O3
Net Charge0
Average Mass152.149
Monoisotopic Mass152.04734
SMILESO=C(O)[C@H](O)c1ccccc1
InChIInChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)/t7-/m1/s1
InChIKeyIWYDHOAUDWTVEP-SSDOTTSWSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
human xenobiotic metabolite  Any human metabolite produced by metabolism of a xenobiotic compound in humans.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
ChEBI Ontology
Outgoing Relation(s)
(R)-mandelic acid (CHEBI:17656) has role human xenobiotic metabolite (CHEBI:76967)
(R)-mandelic acid (CHEBI:17656) is a mandelic acid (CHEBI:35825)
(R)-mandelic acid (CHEBI:17656) is conjugate acid of (R)-mandelate (CHEBI:32382)
(R)-mandelic acid (CHEBI:17656) is enantiomer of (S)-mandelic acid (CHEBI:32800)
Incoming Relation(s)
(R)-mandelate (CHEBI:32382) is conjugate base of (R)-mandelic acid (CHEBI:17656)
(S)-mandelic acid (CHEBI:32800) is enantiomer of (R)-mandelic acid (CHEBI:17656)
IUPAC Name 
(2R)-hydroxy(phenyl)acetic acid
Synonyms  Source
(R)-2-Hydroxy-2-phenylacetic acidKEGG COMPOUND
(R)-Mandelic acidKEGG COMPOUND
(2R)-2-hydroxy-2-phenylacetic acidChEBI
(−)-(R)-mandelic acidChemIDplus
(−)-mandelic acidChemIDplus
(R)-α-hydroxybenzeneacetic acidChemIDplus
Manual XrefsDatabases
C01983KEGG COMPOUND
RMNPDBeChem
CPD-121MetaCyc
Registry NumbersSources
Gmelin:69018Gmelin
Reaxys:2691094Reaxys
CAS:611-71-2ChemIDplus
Citations