| Entry |
|
|---|
| Name |
6-Hydroxykynurenate;
6-Hydroxykynurenic acid;
4,6-Dihydroxyquinaldic acid
|
|---|
| Formula |
C10H7NO4
|
|---|
| Exact mass |
205.0375
|
|---|
| Mol weight |
205.1669
|
|---|
| Structure |
|
|---|
| Comment |
6-Hydroxykynurenic acid (tautomer) [CPD: C08480]
|
|---|
| Reaction |
|
|---|
| Pathway |
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 15
1 C8y C 27.4400 -18.8300
2 C8y C 27.4400 -20.2300
3 N5x N 28.6300 -18.1300
4 C8x C 26.1800 -18.1300
5 C8y C 28.6300 -20.9300
6 C8x C 26.1800 -20.9300
7 C8y C 29.8200 -18.8300
8 C8x C 24.9900 -18.8300
9 C8x C 29.8200 -20.2300
10 O1a O 28.6300 -22.3300
11 C8y C 24.9900 -20.2300
12 C6a C 31.0800 -18.1300
13 O1a O 23.8000 -20.9300
14 O6a O 31.0800 -16.7300
15 O6a O 32.2700 -18.8300
BOND 16
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 3 7 2
7 4 8 1
8 5 9 2
9 5 10 1
10 6 11 1
11 7 12 1
12 11 13 1
13 12 14 2
14 12 15 1
15 7 9 1
16 8 11 2
|
|---|
