Entry |
|
Name |
Polyestradiol phosphate (INN); Estradurin (TN) |
Formula |
(C18H22O4P)n
|
Structure |
|
Simcomp |
|
Class |
|
Remark |
|
Efficacy |
Antineoplastic, Estrogen receptor agonist |
Target |
|
Pathway |
|
Interaction |
|
Structure map |
map07226 | Progesterone, androgen and estrogen receptor agonists/antagonists |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L02 ENDOCRINE THERAPY
L02A HORMONES AND RELATED AGENTS
L02AA Estrogens
L02AA02 Polyestradiol phosphate
D07434 Polyestradiol phosphate (INN)
Drug groups [BR:br08330]
Hormonal agent
DG01986 Estrogen
D07434 Polyestradiol phosphate
DG01584 Estrogen receptor agonist
D07434 Polyestradiol phosphate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A1 (ESR1)
D07434 Polyestradiol phosphate (INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 26
1 C8x C 20.3700 -22.9600
2 C8x C 20.3700 -24.3600
3 C8x C 21.5600 -25.0600
4 C8y C 22.8200 -24.3600
5 C8y C 22.8200 -22.9600
6 C8x C 21.5600 -22.2600
7 C1x C 24.0100 -25.0600
8 C1x C 25.2000 -24.3600
9 C1y C 25.2000 -22.9600
10 C1y C 24.0100 -22.2600
11 C1y C 26.4600 -22.2600
12 C1z C 26.4600 -20.8600
13 C1x C 25.2000 -20.1600
14 C1x C 24.0100 -20.8600
15 C1a C 26.4600 -19.4600
16 Z * 18.6200 -24.3600
17 C1x C 28.8849 -22.2600
18 C1x C 28.8849 -20.8600
19 C1y C 27.6724 -20.1600
20 O2b O 27.6724 -18.7602
21 P1b P 28.8680 -18.0698
22 O1c O 30.0614 -17.3757
23 O1c O 29.5584 -19.2616
24 O1c O 28.1551 -16.8390
25 Z * 32.4984 -19.2616
26 Z * 32.5057 -17.3544
BOND 29
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
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 12 15 1 #Up
18 2 16 1
19 11 17 1
20 17 18 1
21 18 19 1
22 12 19 1
23 19 20 1 #Up
24 20 21 1
25 21 22 1
26 21 23 1
27 21 24 2
28 23 25 1
29 22 26 1
BRACKET 1 20.0900 -25.5500 20.0900 -15.9600
1 31.6400 -16.1700 31.6400 -25.7600
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16
1 17 18 20 21 22 23 24 25 26 27
REPEAT 1
|