| Entry |
|
|---|
| Name |
Estradiol valerate (JAN/USP/INN);
Deladumone (TN) |
|---|
| Product |
|
|---|
| Generic |
|
|---|
| Formula |
C23H32O3
|
|---|
| Exact mass |
356.2351
|
|---|
| Mol weight |
356.4984
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Hormonal agent
DG01986 Estrogen
DG01584 Estrogen receptor agonist
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
|
|---|
| Remark |
| Therapeutic category: | 2473 |
| Product (DG00462): | D00105<JP/US> D01413<JP/US> D04061<US> D04063<US> D07918<US> |
| Product (mixture): | D04454<JP> D04459<US> D10461<US> |
|
|---|
| Efficacy |
Menstruation disorder agent, Estrogen receptor agonist |
|---|
| Disease |
Advanced androgen-dependent carcinoma of the prostate [DS: H00024] |
|---|
| Comment |
Estrogen
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Metabolism |
Enzyme: CYP3A4 [HSA: 1576]
|
|---|
| Interaction |
|
|---|
| 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
G03CA Natural and semisynthetic estrogens, plain
G03CA03 Estradiol
D01413 Estradiol valerate (JAN/USP/INN) <JP/US>
USP drug classification [BR:br08302]
Hormonal Agents, Stimulant/Replacement/Modifying (Sex Hormones/Modifiers)
Estrogens
Estradiol
D01413 Estradiol valerate (JAN/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
24 Hormones
247 Estrogen and progesterone preparations
2473 Estradiols
D01413 Estradiol valerate (JAN/USP/INN)
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
DG00462 Estradiol
D01413 Estradiol valerate
DG01584 Estrogen receptor agonist
DG00462 Estradiol
D01413 Estradiol valerate
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00462 Estradiol
D01413 Estradiol valerate
Drug classes [BR:br08332]
Endocrine and hormonal agent
DG01986 Estrogen
D01413 Estradiol valerate
DG01584 Estrogen receptor agonist
D01413 Estradiol valerate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D01413 Estradiol valerate (JAN/USP/INN) <JP/US>
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D01413
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
DG00462 Estradiol
DG01584 Estrogen receptor agonist
DG00462 Estradiol
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG02913 CYP3A4 substrate
DG00462 Estradiol
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 26
1 C1y C 21.7770 -18.3828
2 C1y C 20.5804 -19.0567
3 C1z C 21.7886 -17.0060
4 C1x C 24.1646 -18.4002
5 C1y C 19.3954 -18.3596
6 C1x C 20.5804 -20.4276
7 C1y C 22.9854 -16.3321
8 C1x C 20.6036 -16.3148
9 C1a C 21.7364 -15.7861
10 C1x C 24.1762 -17.0292
11 C8y C 18.1987 -19.0392
12 C1x C 19.4069 -16.9827
13 C1x C 19.3895 -21.1131
14 O7a O 22.9738 -14.9555
15 C8y C 18.1929 -20.4160
16 C8x C 17.0194 -18.3537
17 C8x C 17.0194 -21.1072
18 C8x C 15.8286 -19.0392
19 C8y C 15.8286 -20.4160
20 O1a O 14.6261 -21.1072
21 C7a C 24.1719 -14.2605
22 C1b C 25.3722 -14.9485
23 C1b C 26.5725 -14.2536
24 C1b C 27.7727 -14.9415
25 O6a O 24.1648 -12.8707
26 C1a C 28.9742 -14.2427
BOND 29
1 7 10 1
2 8 12 1
3 13 15 1
4 18 19 1
5 1 2 1
6 1 3 1
7 1 4 1
8 2 5 1
9 2 6 1
10 3 7 1
11 3 8 1
12 3 9 1 #Up
13 4 10 1
14 5 11 1
15 5 12 1
16 6 13 1
17 7 14 1 #Up
18 11 15 2
19 14 21 1
20 11 16 1
21 21 22 1
22 15 17 1
23 22 23 1
24 16 18 2
25 23 24 1
26 17 19 2
27 21 25 2
28 19 20 1
29 24 26 1
|
|---|
