Entry |
|
Name |
Deserpidine (INN); Halmonyl (TN) |
Formula |
C32H38N2O8
|
Exact mass |
578.2628
|
Mol weight |
578.6527
|
Structure |
|
Simcomp |
|
Source |
Rauwolfia canescens
|
Class |
Cardiovascular agent
DG01738 Centrally-acting antiadrenergic
DG01737 Rauwolfia alkaloid
|
Remark |
|
Efficacy |
Antihypertensive |
Comment |
Rauwolfia alkaloid
|
Interaction |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C02 ANTIHYPERTENSIVES
C02A ANTIADRENERGIC AGENTS, CENTRALLY ACTING
C02AA Rauwolfia alkaloids
C02AA05 Deserpidine
D08194 Deserpidine (INN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01738 Centrally-acting antiadrenergic
DG01737 Rauwolfia alkaloid
D08194 Deserpidine
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 42
1 C8x C 14.7000 -18.7600
2 C8x C 14.7000 -20.1600
3 C8x C 15.9124 -20.8600
4 C8y C 17.1249 -20.1600
5 C8y C 17.1249 -18.7600
6 C8x C 15.9124 -18.0600
7 N4x N 18.4564 -20.5926
8 C8y C 19.2793 -19.4600
9 C8y C 18.4564 -18.3274
10 C1y C 20.6716 -19.3137
11 N1y N 21.2410 -18.0347
12 C1x C 20.4181 -16.9021
13 C1x C 19.0258 -17.0484
14 C1x C 21.4945 -20.4463
15 C1y C 22.8868 -20.2999
16 C1y C 23.4563 -19.0210
17 C1x C 22.6334 -17.8883
18 C1y C 23.7097 -21.4325
19 C1y C 25.1021 -21.2862
20 C1y C 25.6715 -20.0072
21 C1x C 24.8486 -18.8746
22 C7a C 23.1485 -22.6935
23 O6a O 21.7789 -22.6975
24 O7a O 23.9723 -23.8273
25 O2a O 25.9314 -22.4280
26 C1a C 27.2952 -22.4242
27 C1a C 25.3351 -23.8233
28 O7a O 27.0807 -19.9989
29 C7a C 27.7668 -18.7945
30 C8y C 29.1897 -18.7868
31 C8x C 29.8848 -19.9754
32 C8y C 31.2848 -19.9677
33 C8y C 31.9780 -18.7514
34 C8y C 31.2830 -17.5628
35 C8x C 29.8830 -17.5706
36 O6a O 27.0508 -17.5710
37 O2a O 31.9749 -16.3490
38 C1a C 33.3895 -16.4108
39 O2a O 33.3899 -18.7435
40 O2a O 31.9852 -21.1652
41 C1a C 33.3899 -21.1574
42 C1a C 34.0761 -17.5396
BOND 47
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 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 9 13 1
16 10 14 1
17 14 15 1
18 15 16 1
19 16 17 1
20 11 17 1
21 15 18 1
22 18 19 1
23 19 20 1
24 20 21 1
25 16 21 1
26 18 22 1 #Up
27 22 23 2
28 22 24 1
29 19 25 1 #Down
30 25 26 1
31 24 27 1
32 20 28 1 #Up
33 28 29 1
34 29 30 1
35 30 31 2
36 31 32 1
37 32 33 2
38 33 34 1
39 34 35 2
40 30 35 1
41 29 36 2
42 34 37 1
43 37 38 1
44 33 39 1
45 32 40 1
46 40 41 1
47 39 42 1
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