Entry |
|
Name |
Papaverine (BAN); Mesotina (TN) |
Formula |
C20H21NO4
|
Exact mass |
339.1471
|
Mol weight |
339.385
|
Structure |
|
Simcomp |
|
Source |
Papaver somniferum [TAX: 3469]
|
Remark |
Product (DG00043): | D02218<JP> |
|
Efficacy |
Antispasmodic, Smooth muscle relaxant, Vasodilator, Phosphodiesterase inhibitor |
Comment |
Papaverine derivative
|
Target |
|
Pathway |
|
Interaction |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03A DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03AD Papaverine and derivatives
A03AD01 Papaverine
D07425 Papaverine (BAN)
G GENITO URINARY SYSTEM AND SEX HORMONES
G04 UROLOGICALS
G04B UROLOGICALS
G04BE Drugs used in erectile dysfunction
G04BE02 Papaverine
D07425 Papaverine (BAN)
Risk category of Japanese OTC drugs [BR:br08312]
Second-class OTC drugs
Inorganic and organic chemicals
Papaverine
D07425 Papaverine (BAN)
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Phosphodiesterases
PDE
D07425 Papaverine (BAN)
|
Other DBs |
|
KCF data |
ATOM 25
1 C8y C 17.3795 -14.8035
2 C8y C 17.3795 -13.4066
3 C8y C 18.5668 -15.5020
4 C8x C 16.1921 -15.5020
5 C8x C 16.1921 -12.7082
6 C8x C 18.6367 -12.7082
7 C1b C 18.5668 -16.8989
8 N5x N 19.8241 -14.8035
9 C8y C 15.0047 -14.8035
10 C8y C 15.0047 -13.4066
11 C8x C 19.8241 -13.4066
12 C8y C 19.8241 -17.5974
13 O2a O 13.7475 -15.5020
14 O2a O 13.7475 -12.7082
15 C8x C 21.0813 -16.8989
16 C8x C 19.8241 -18.9943
17 C1a C 12.5601 -14.8035
18 C1a C 12.5601 -13.4066
19 C8y C 22.2687 -17.5974
20 C8x C 21.0114 -19.6927
21 C8y C 22.2685 -18.9943
22 O2a O 23.4560 -16.8291
23 O2a O 23.4560 -19.6229
24 C1a C 24.6434 -17.5275
25 C1a C 24.7132 -18.9244
BOND 27
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 1
10 6 11 2
11 7 12 1
12 9 13 1
13 10 14 1
14 12 15 1
15 12 16 2
16 13 17 1
17 14 18 1
18 15 19 2
19 16 20 1
20 19 21 1
21 19 22 1
22 21 23 1
23 8 11 1
24 9 10 2
25 20 21 2
26 22 24 1
27 23 25 1
|