KEGG   COMPOUND: C03198Help
Entry
C03198                      Compound                               

Name
(S)-4-Hydroxymandelate;
(S)-2-Hydroxy-2-(4-hydroxyphenyl)acetate;
L-4-Hydroxymandelate;
L-p-Hydroxymandelate
Formula
C8H8O4
Exact mass
168.0423
Mol weight
168.1467
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
4-Hydroxymandelate [CPD:C11527]
Reaction
Pathway
Monobactam biosynthesis
Aminobenzoate degradation
Biosynthesis of vancomycin group antibiotics
Microbial metabolism in diverse environments
Biosynthesis of antibiotics
Enzyme
1.1.3.19        1.1.3.46        1.1.99.31       1.13.11.46      
1.14.16.6       5.1.2.2
Other DBs
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        12
            1   C1c C    27.6827  -15.2485
            2   C8y C    26.4734  -15.9495
            3   C6a C    28.8984  -15.9431
            4   O1a O    27.6827  -13.9871
            5   C8x C    26.4734  -17.3647
            6   C8x C    25.2450  -15.2485
            7   O6a O    28.8984  -17.4156
            8   O6a O    30.1075  -15.2357
            9   C8x C    25.2450  -18.0784
            10  C8x C    24.0358  -15.9495
            11  C8y C    24.0358  -17.3647
            12  O1a O    22.8202  -18.0592
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 2
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     5   9 1
            9     6  10 2
            10    9  11 2
            11   11  12 1
            12   10  11 1

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