| Entry |
|
|---|
| Name |
Desoxycorticosterone acetate (USP);
Doca (TN) |
|---|
| Formula |
C23H32O4
|
|---|
| Exact mass |
372.2301
|
|---|
| Mol weight |
372.50
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Salts metabolic regulator, Mineralocorticoid receptor agonist |
|---|
| Comment |
Desoxycorticosterone is called Desoxycortone in INN.
Name previously used: Deoxycortone
Adrenocortical steroid
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04960 | Aldosterone-regulated sodium reabsorption |
|
|---|
| Structure map |
| map07225 | Glucocorticoid and mineralocorticoid receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
H02 CORTICOSTEROIDS FOR SYSTEMIC USE
H02A CORTICOSTEROIDS FOR SYSTEMIC USE, PLAIN
H02AA Mineralocorticoids
H02AA03 Desoxycortone
D03698 Desoxycorticosterone acetate (USP)
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C2 (MR)
D03698 Desoxycorticosterone acetate (USP)
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 27
1 C1x C 24.7068 -17.1717
2 C5x C 24.7068 -18.5387
3 C2x C 25.8906 -19.2222
4 C2y C 27.0745 -18.5387
5 C1z C 27.0745 -17.1717
6 C1x C 25.8906 -16.4882
7 C1x C 28.2584 -19.2222
8 C1x C 29.4422 -18.5387
9 C1y C 29.4422 -17.1717
10 C1y C 28.2584 -16.4882
11 C1y C 30.6261 -16.4882
12 C1z C 30.6261 -15.1211
13 C1x C 29.4422 -14.4376
14 C1x C 28.2584 -15.1211
15 C1x C 32.9938 -16.4882
16 C1x C 32.9938 -15.1211
17 C1y C 31.8100 -14.4376
18 C5a C 31.8100 -12.7272
19 O5a O 32.9978 -12.0415
20 C1b C 30.6301 -12.0459
21 O7a O 29.4647 -12.7190
22 C7a C 28.3044 -12.0491
23 C1a C 27.1417 -12.7206
24 O6a O 28.3042 -10.6769
25 O5x O 23.5229 -19.2222
26 C1a C 30.6261 -13.7541
27 C1a C 27.0745 -15.8046
BOND 30
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
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 17 18 1 #Up
22 18 19 2
23 18 20 1
24 20 21 1
25 21 22 1
26 22 23 1
27 22 24 2
28 2 25 2
29 12 26 1 #Up
30 5 27 1 #Up
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