| Entry |
|
|---|
| Name |
Raloxifene (INN);
Eviden (TN);
Raxeto (TN)
|
|---|
| Formula |
C28H27NO4S
|
|---|
| Exact mass |
473.1661
|
|---|
| Mol weight |
473.5833
|
|---|
| Structure |
   |
|---|
| Simcomp |
 |
|---|
| Class |
Other
DG01619 Clomifene and tamoxifen derivative
DG01621 Cloimifene-type osteoporosis agent
|
|---|
| Remark |
| Product (DG00476): | D02217<JP/US> D10606<JP> |
|
|---|
| Efficacy |
Osteoporosis agent, Selective estrogen receptor modulator (SERM) |
|---|
| Comment |
Benzothiophene derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04961 | Endocrine and other factor-regulated calcium reabsorption |
|
|---|
| 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
G03X OTHER SEX HORMONES AND MODULATORS OF THE GENITAL SYSTEM
G03XC Selective estrogen receptor modulators
G03XC01 Raloxifene
D08465 Raloxifene (INN)
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D08465 Raloxifene (INN)
 |
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 34
1 C8y C 18.6200 -17.5000
2 C8x C 18.6200 -18.9000
3 C8x C 19.8100 -19.6000
4 C8y C 21.0700 -18.9000
5 C8x C 21.0700 -17.5000
6 C8x C 19.8100 -16.8000
7 C5a C 17.4300 -16.8000
8 C8y C 16.2400 -17.5000
9 O5a O 17.4300 -15.4000
10 O2a O 22.2600 -19.6000
11 C1b C 23.4500 -18.9000
12 C1b C 24.6400 -19.6000
13 N1y N 25.8300 -18.9000
14 C1x C 27.0900 -19.6000
15 C1x C 28.3500 -18.9000
16 C1x C 28.3500 -17.5000
17 C1x C 27.1600 -16.8000
18 C1x C 25.8300 -17.5000
19 C8y C 15.1200 -16.6600
20 S2x S 14.0000 -17.4300
21 C8y C 14.4200 -18.7600
22 C8y C 15.7500 -18.7600
23 C8x C 13.6500 -19.9500
24 C8y C 14.3500 -21.2800
25 C8x C 15.7500 -21.2800
26 C8x C 16.4500 -20.0200
27 C8y C 15.1200 -15.2600
28 C8x C 13.9300 -13.1600
29 C8x C 13.9300 -14.5600
30 C8x C 16.3800 -14.5600
31 C8x C 16.3800 -13.1600
32 C8y C 15.1200 -12.4600
33 O1a O 15.1200 -11.0600
34 O1a O 13.6500 -22.4700
BOND 38
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 1 7 1
8 7 8 1
9 7 9 2
10 4 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 13 18 1
20 8 19 2
21 19 20 1
22 20 21 1
23 21 22 1
24 8 22 1
25 21 23 2
26 23 24 1
27 24 25 2
28 25 26 1
29 22 26 2
30 19 27 1
31 28 29 2
32 29 27 1
33 30 31 1
34 31 32 2
35 28 32 1
36 32 33 1
37 27 30 2
38 24 34 1
|
|---|
