(S)-4-hydroxymandelate
Chemical Formula:
C8H7O4
Molecular Weight:
167.141 Daltons
Monoisotopic Mass:
168.0422587452 Daltons
SMILES:
C(=O)([O-])C(C1(C=CC(=CC=1)O))O
InChI:
1S/C8H8O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/p-1/t7-/m0/s1
InChIKey:
Synonyms
- (S)-2-hydroxy-2-(4-hydroxyphenyl)acetate
- L-p-hydroxymandelate
- L-4-hydroxymandelate
Databases
MetaCyc:
CPD-106
ChemSpider:
4573935
PubChem (CID):
5460397
KEGG:
C03198
Seed:
cpd02043
MetaNetX:
MNXM1301
PupChem (SID):
6075
PDB-CCD:
HHH
3DMET:
B00557
NIKKAJI:
J74.174D