Entry |
|
Name |
Vanillate;
Vanillic acid;
4-Hydroxy-3-methoxybenzoate;
4-Hydroxy-3-methoxybenzoic acid
|
Formula |
C8H8O4
|
Exact mass |
168.0423
|
Mol weight |
168.1467
|
Structure |

|
Reaction |
|
Pathway |
map01120 | Microbial metabolism in diverse environments |
|
Enzyme |
|
Brite |
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 12
1 C8x C 32.1765 -26.9975
2 C8x C 32.1765 -25.5947
3 C8y C 33.3689 -24.8933
4 C8y C 34.6314 -25.5947
5 C8x C 34.6314 -26.9975
6 C8y C 33.3689 -27.6989
7 O1a O 33.3689 -23.4905
8 C6a C 33.3689 -29.1017
9 O6a O 32.1765 -29.8031
10 O6a O 34.5612 -29.8031
11 O2a O 35.8238 -24.8933
12 C1a C 37.0161 -25.5947
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 3 7 1
8 6 8 1
9 8 9 2
10 8 10 1
11 4 11 1
12 11 12 1
|