| Entry |
|
|---|
| Name |
Diethylstilbestrol (USP/INN);
Stilbestrol (TN) |
|---|
| Formula |
C18H20O2
|
|---|
| Exact mass |
268.1463
|
|---|
| Mol weight |
268.35
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01584 Estrogen receptor agonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Tocolytic, Estrogen receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Structure map |
| map07226 | Progesterone, androgen and estrogen receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
G GENITO URINARY SYSTEM AND SEX HORMONES
G03 SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
G03C ESTROGENS
G03CB Synthetic estrogens, plain
G03CB02 Diethylstilbestrol
D00577 Diethylstilbestrol (USP/INN)
G03CC Estrogens, combinations with other drugs
G03CC05 Diethylstilbestrol
D00577 Diethylstilbestrol (USP/INN)
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L02 ENDOCRINE THERAPY
L02A HORMONES AND RELATED AGENTS
L02AA Estrogens
L02AA01 Diethylstilbestrol
D00577 Diethylstilbestrol (USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
First-class OTC drugs
Inorganic and organic chemicals
Diethylstilbestrol
D00577 Diethylstilbestrol (USP/INN)
Drug groups [BR:br08330]
Hormonal agent
DG01584 Estrogen receptor agonist
DG00466 Diethylstilbestrol
D00577 Diethylstilbestrol
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D00577 Diethylstilbestrol (USP/INN)
Prodrugs [br08324.html]
D00577
Drug groups [BR:br08330]
Hormonal agent
DG01584 Estrogen receptor agonist
DG00466 Diethylstilbestrol
Prodrugs [br08324.html]
DG00466
|
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| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 20
1 C2c C 21.7643 -16.3168
2 C2c C 21.7757 -17.7091
3 C8y C 20.5467 -15.6235
4 C1b C 22.9759 -15.6119
5 C8y C 22.9875 -18.4081
6 C1b C 20.5700 -18.4081
7 C8x C 19.3349 -16.3168
8 C8x C 20.5467 -14.2197
9 C1a C 24.1875 -16.3052
10 C8x C 22.9875 -19.8063
11 C8x C 24.1992 -17.7032
12 C1a C 19.3582 -17.7148
13 C8x C 18.1233 -15.6235
14 C8x C 19.3349 -13.5147
15 C8x C 24.2051 -20.5053
16 C8x C 25.4167 -18.4022
17 C8y C 18.1233 -14.2197
18 C8y C 25.4167 -19.8003
19 O1a O 16.9058 -13.5147
20 O1a O 26.6285 -20.5053
BOND 21
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 3 8 1
8 4 9 1
9 5 10 2
10 5 11 1
11 6 12 1
12 7 13 1
13 8 14 2
14 10 15 1
15 11 16 2
16 13 17 2
17 15 18 2
18 17 19 1
19 18 20 1
20 14 17 1
21 16 18 1
|
|---|
