Entry |
|
Name |
3-(2,3-Dihydroxyphenyl)propanoate;
2,3-Dihydroxyphenylpropanoate
|
Formula |
C9H10O4
|
Exact mass |
182.0579
|
Mol weight |
182.17
|
Structure |
|
Reaction |
|
Pathway |
map01120 | Microbial metabolism in diverse environments |
map01220 | Degradation of aromatic compounds |
|
Enzyme |
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 13
1 C8y C 17.8468 -14.7491
2 C8y C 16.6431 -15.4442
3 C8x C 17.8468 -13.3460
4 C1b C 19.0633 -15.4508
5 C8y C 15.4266 -14.7491
6 O1a O 16.6431 -16.9810
7 C8x C 16.6367 -12.6380
8 C1b C 20.2734 -14.7491
9 C8x C 15.4266 -13.3523
10 O1a O 14.2165 -15.4571
11 C6a C 21.4835 -15.4508
12 O6a O 21.4835 -16.9874
13 O6a O 22.7000 -14.7491
BOND 13
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 1
8 5 9 2
9 5 10 1
10 8 11 1
11 11 12 1
12 11 13 2
13 7 9 1
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