| Entry |
|
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| Name |
Estriol diacetate benzoate (JAN);
Estriol benzoate diacetate;
Holin (TN) |
|---|
| Formula |
C29H32O6
|
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| Exact mass |
476.2199
|
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| Mol weight |
476.56
|
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| Structure |
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| Simcomp |
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| Class |
|
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| Remark |
| Product (DG00463): | D00185<JP> |
|
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| Efficacy |
Menstruation disorder agent, Estrogen receptor agonist |
|---|
| Comment |
Estrogen
|
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| Target |
|
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| Pathway |
|
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| Interaction |
|
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| Structure map |
| map07226 | Progesterone, androgen and estrogen receptor agonists/antagonists |
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| 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
G03CA04 Estriol
D01989 Estriol diacetate benzoate (JAN)
G03CC Estrogens, combinations with other drugs
G03CC06 Estriol
D01989 Estriol diacetate benzoate (JAN)
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
DG00463 Estriol
D01989 Estriol diacetate benzoate
DG01584 Estrogen receptor agonist
DG00463 Estriol
D01989 Estriol diacetate benzoate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D01989 Estriol diacetate benzoate (JAN)
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
DG00463 Estriol
DG01584 Estrogen receptor agonist
DG00463 Estriol
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 35
1 C8x C 16.3800 -31.6400
2 C8y C 16.3800 -33.0400
3 C8x C 17.5924 -33.7400
4 C8y C 18.8049 -33.0400
5 C8y C 18.8049 -31.6400
6 C8x C 17.5924 -30.9400
7 C1x C 20.0173 -33.7400
8 C1x C 21.2297 -33.0400
9 C1y C 21.2297 -31.6400
10 C1y C 20.0173 -30.9400
11 C1y C 22.4422 -30.9400
12 C1z C 22.4422 -29.5400
13 C1x C 21.2297 -28.8400
14 C1x C 20.0173 -29.5400
15 C1x C 24.8670 -30.9400
16 C1y C 24.8670 -29.5400
17 C1y C 23.6546 -28.8400
18 O7a O 15.1676 -33.7400
19 C7a C 13.9721 -33.0496
20 C8y C 12.7847 -33.7351
21 O6a O 13.9720 -31.6403
22 C8x C 11.5935 -33.0471
23 C8x C 10.3810 -33.7469
24 C8x C 10.3808 -35.1469
25 C8x C 11.5720 -35.8349
26 C8x C 12.7845 -35.1351
27 O7a O 23.6546 -27.4400
28 C7a C 24.8711 -26.7377
29 C1a C 26.0686 -27.4292
30 O6a O 24.8711 -25.3402
31 O7a O 26.0666 -28.8473
32 C7a C 27.2559 -29.5340
33 C1a C 28.4462 -28.8466
34 O6a O 27.2560 -30.9398
35 C1a C 22.4422 -28.1400
BOND 39
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 2 18 1
22 18 19 1
23 19 20 1
24 19 21 2
25 20 22 2
26 22 23 1
27 23 24 2
28 24 25 1
29 25 26 2
30 20 26 1
31 17 27 1 #Up
32 27 28 1
33 28 29 1
34 28 30 2
35 16 31 1 #Down
36 31 32 1
37 32 33 1
38 32 34 2
39 12 35 1 #Up
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