| Entry |
|
|---|
| Name |
Uredepa (USAN/INN) |
|---|
| Formula |
C7H14N3O3P
|
|---|
| Exact mass |
219.0773
|
|---|
| Mol weight |
219.18
|
|---|
| Structure |
|
|---|
| Class |
|
|---|
| Efficacy |
Antineoplastic, Alkylating agent |
|---|
| Comment |
thiotepa derivative
|
|---|
| Target |
DNA |
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG01677 Alkylating agent
DG01723 Ethylene imine
DG01722 Thiotepa type ethylene imine
D06266 Uredepa
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 14
1 P1a P 11.3400 -20.5100
2 N1y N 11.3400 -19.1100
3 N1y N 9.9400 -20.5100
4 N1b N 12.7400 -20.5100
5 O3b O 11.3400 -21.9100
6 C1x C 10.6400 -17.9200
7 C1x C 12.0400 -17.9200
8 C1x C 8.6800 -21.2100
9 C1x C 8.6800 -19.8100
10 C7a C 13.4400 -21.7224
11 O7a O 14.8398 -21.7224
12 O6a O 12.7496 -22.9179
13 C1b C 15.5303 -22.9180
14 C1a C 16.9397 -22.9180
BOND 15
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 2
5 6 7 1
6 7 2 1
7 2 6 1
8 8 3 1
9 9 8 1
10 9 3 1
11 4 10 1
12 10 11 1
13 10 12 2
14 11 13 1
15 13 14 1
|
|---|
