KEGG   COMPOUND: C01198Help
Entry
C01198                      Compound                               

Name
3-(2-Hydroxyphenyl)propanoate;
2-Hydroxyphenylpropanoate;
3-(2-Hydroxyphenyl)propionic acid;
Melilotate;
3-(2-Hydroxyphenyl)propionate
Formula
C9H10O3
Exact mass
166.063
Mol weight
166.1739
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Phenylalanine metabolism
Polycyclic aromatic hydrocarbon degradation
Microbial metabolism in diverse environments
Enzyme
1.3.1.11        1.14.13.4       3.1.1.35
Other DBs
CAS: 
495-78-3
PubChem: 
ChEBI: 
KNApSAcK: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        12
            1   C8x C    19.1800  -18.7600
            2   C8x C    19.1800  -20.1600
            3   C8x C    20.3924  -20.8600
            4   C8y C    21.6049  -20.1600
            5   C8y C    21.6049  -18.7600
            6   C8x C    20.3924  -18.0600
            7   O1a O    22.8360  -18.0490
            8   C1b C    22.8424  -20.8600
            9   C1b C    24.0549  -20.1600
            10  C6a C    25.2673  -20.8600
            11  O6a O    26.4797  -20.1600
            12  O6a O    25.2673  -22.2600
BOND        12
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     4   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   10  12 2

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