| Entry |
|
|---|
| Name |
Doxecitine (USAN/INN) |
|---|
| Formula |
C9H13N3O4
|
|---|
| Exact mass |
227.0906
|
|---|
| Mol weight |
227.2172
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Efficacy |
Methabolic disease therapeutic agent |
|---|
| Comment |
Treatment of thymidine kinase 2 deficiency
|
|---|
| Target |
|
|---|
| Pathway |
| hsa00983 | Drug metabolism - other enzymes |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Phosphotransferase
TK2
D12465 Doxecitine (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 16
1 C1y C 16.1728 -18.9724
2 N4y N 17.5030 -18.4123
3 O2x O 14.9826 -18.2023
4 C1x C 15.6827 -20.3026
5 C8y C 18.7632 -19.1124
6 C8x C 17.5030 -17.0121
7 C1y C 13.8624 -18.9724
8 C1y C 14.2825 -20.3026
9 N5x N 19.9533 -18.4123
10 O5x O 18.7632 -20.5127
11 C8x C 18.6932 -16.3120
12 C1b C 12.5322 -18.5524
13 O1a O 13.5124 -21.4228
14 C8y C 19.9533 -17.0121
15 O1a O 11.5521 -19.5325
16 N1a N 21.1435 -16.3120
BOND 17
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 2
10 6 11 2
11 7 12 1 #Up
12 8 13 1 #Down
13 9 14 2
14 12 15 1
15 14 16 1
16 7 8 1
17 11 14 1
|
|---|
