| Entry |
|
|---|
| Name |
3-(2-Hydroxyphenyl)propanoate;
2-Hydroxyphenylpropanoate;
3-(2-Hydroxyphenyl)propionic acid;
Melilotate;
3-(2-Hydroxyphenyl)propionate
|
|---|
| Formula |
C9H10O3
|
|---|
| Exact mass |
166.0630
|
|---|
| Mol weight |
166.17
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00624 | Polycyclic aromatic hydrocarbon degradation |
| map00999 | Biosynthesis of various plant secondary metabolites |
| map01120 | Microbial metabolism in diverse environments |
|
|---|
| Enzyme |
|
|---|
| Other DBs |
|
|---|
| KCF data |
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
|
|---|
