| Entry |
|
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| Name |
Estriol sodium succinate (BAN);
Estriol 16alpha, 17beta-di (sodium succinate);
Styptanon (TN) |
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| Formula |
C26H30O9. 2Na
|
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| Exact mass |
532.1685
|
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| Mol weight |
532.4905
|
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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 |
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| 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
D07921 Estriol sodium succinate (BAN)
G03CC Estrogens, combinations with other drugs
G03CC06 Estriol
D07921 Estriol sodium succinate (BAN)
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
DG00463 Estriol
D07921 Estriol sodium succinate
DG01584 Estrogen receptor agonist
DG00463 Estriol
D07921 Estriol sodium succinate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D07921 Estriol sodium succinate (BAN)
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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| KCF data |
ATOM 37
1 C1y C 24.1500 -21.2100
2 C1y C 22.8900 -21.9100
3 C1z C 24.1500 -19.8100
4 C1x C 26.5300 -21.2100
5 C1y C 21.7000 -21.2100
6 C1x C 22.8900 -23.3100
7 C1y C 25.3400 -19.0400
8 C1x C 22.8900 -19.1800
9 C1a C 24.0800 -18.3400
10 C1y C 26.5300 -19.8100
11 C8y C 20.4400 -21.9100
12 C1x C 21.7000 -19.8100
13 C1x C 21.7000 -24.0100
14 O7a O 25.3400 -17.4300
15 O7a O 27.7900 -19.1800
16 C8y C 20.4400 -23.3100
17 C8x C 19.3200 -21.2100
18 C8x C 19.3200 -24.0100
19 C8x C 18.1300 -21.9100
20 C8y C 18.1300 -23.3100
21 O1a O 16.9400 -24.0100
22 C7a C 28.9800 -19.8800
23 C1b C 30.1700 -19.2500
24 C1b C 31.4300 -20.0200
25 C6a C 32.6900 -19.3200
26 O6a O 33.9500 -20.0900 #-
27 O6a O 32.6900 -17.9200
28 O6a O 28.9800 -21.3500
29 C7a C 26.5524 -16.7300
30 C1b C 27.7479 -17.4204
31 O6a O 26.5525 -15.3302
32 C1b C 28.9353 -16.7349
33 C6a C 30.1265 -17.4229
34 O6a O 31.3160 -16.7362 #-
35 O6a O 30.1265 -18.8297
36 Z Na 30.9400 -15.4000 #+
37 Z Na 35.7700 -20.2300 #+
BOND 38
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 1 #Up
14 10 15 1 #Down
15 11 16 2
16 11 17 1
17 16 18 1
18 17 19 2
19 18 20 2
20 20 21 1
21 7 10 1
22 8 12 1
23 13 16 1
24 19 20 1
25 15 22 1
26 22 23 1
27 23 24 1
28 24 25 1
29 25 26 1
30 25 27 2
31 22 28 2
32 14 29 1
33 29 30 1
34 29 31 2
35 30 32 1
36 32 33 1
37 33 34 1
38 33 35 2
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