| Entry |
|
|---|
| Name |
Droloxifene citrate (USAN) |
|---|
| Formula |
C26H29NO2. C6H8O7
|
|---|
| Exact mass |
579.2468
|
|---|
| Mol weight |
579.64
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Antineoplastic
DG01585 Estrogen receptor antagonist
DG01620 Tamoxifene-type antineoplastic
Hormonal agent
DG01619 Estrogen receptor antagonist/modulator
|
|---|
| Remark |
|
|---|
| Efficacy |
Antineoplastic, Estrogen receptor agonist/antagonist |
|---|
| Comment |
Selective estrogen receptor modifier (SERM)
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG01585 Estrogen receptor antagonist
DG01620 Tamoxifene-type antineoplastic
DG01265 Droloxifene
D03912 Droloxifene citrate
Hormonal agent
DG01619 Estrogen receptor antagonist/modulator
DG01265 Droloxifene
D03912 Droloxifene citrate
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
Estrogen receptor
NR3A (ESR)
D03912 Droloxifene citrate (USAN)
Drug groups [BR:br08330]
Antineoplastic
DG01585 Estrogen receptor antagonist
DG01620 Tamoxifene-type antineoplastic
DG01265 Droloxifene
Hormonal agent
DG01619 Estrogen receptor antagonist/modulator
DG01265 Droloxifene
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 42
1 C1d C 38.3199 -16.1231
2 C1b C 37.1097 -16.8186
3 C1b C 39.5302 -16.8128
4 C6a C 39.0098 -14.9069
5 O1a O 37.6125 -14.9069
6 C6a C 35.9052 -16.1288
7 C6a C 39.5184 -18.2102
8 O6a O 38.3023 -13.6909
9 O6a O 40.4129 -14.9069
10 O6a O 34.6952 -16.8303
11 O6a O 35.8936 -14.7315
12 O6a O 40.7287 -18.9117
13 O6a O 38.3023 -18.9058
14 C8y C 23.0755 -18.6227
15 C8x C 23.0755 -20.0273
16 C8x C 24.2919 -20.7296
17 C8x C 25.5085 -20.0273
18 C8y C 25.5085 -18.6227
19 C8x C 24.2919 -17.9204
20 C8x C 27.9413 -20.0273
21 C8y C 27.9413 -18.6227
22 C2c C 26.7249 -17.9204
23 C8x C 29.1578 -20.7296
24 C8y C 30.3742 -20.0273
25 C8x C 30.3742 -18.6227
26 C8x C 29.1578 -17.9204
27 O1a O 21.8591 -17.9204
28 C2c C 26.7249 -16.5157
29 C8y C 27.9434 -15.8122
30 C1b C 25.5105 -15.8146
31 C1a C 24.3120 -16.5067
32 C8x C 29.1439 -16.5055
33 C8x C 30.3604 -15.8033
34 C8x C 30.3605 -14.3986
35 C8x C 29.1600 -13.7054
36 C8x C 27.9435 -14.4075
37 O2a O 31.5948 -20.7319
38 C1b C 32.7962 -20.0382
39 C1b C 33.9865 -20.7253
40 N1c N 35.1822 -20.0347
41 C1a C 36.3754 -20.7235
42 C1a C 35.1822 -18.6230
BOND 43
1 3 7 1
2 4 8 1
3 4 9 2
4 6 10 1
5 6 11 2
6 7 12 1
7 7 13 2
8 1 2 1
9 1 3 1
10 1 4 1
11 1 5 1
12 2 6 1
13 14 15 2
14 15 16 1
15 16 17 2
16 17 18 1
17 18 19 2
18 14 19 1
19 20 21 1
20 21 22 1
21 18 22 1
22 20 23 2
23 23 24 1
24 24 25 2
25 25 26 1
26 21 26 2
27 14 27 1
28 22 28 2
29 28 29 1
30 28 30 1
31 30 31 1
32 29 32 2
33 32 33 1
34 33 34 2
35 34 35 1
36 35 36 2
37 29 36 1
38 24 37 1
39 37 38 1
40 38 39 1
41 39 40 1
42 40 41 1
43 40 42 1
|
|---|
