Entry
Name
Hydroquinine; Dihydroquinine; Neostrata (TN)
Formula
C20H26N2O2
Exact mass
326.1994
Mol weight
326.43
Structure
Mol file KCF file DB search
Simcomp
Neighbor
Remark
Efficacy
Antimalarial, Demelanizing, Muscle relaxant
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303 ]
M MUSCULO-SKELETAL SYSTEM
M09 OTHER DRUGS FOR DISORDERS OF THE MUSCULO-SKELETAL SYSTEM
M09A OTHER DRUGS FOR DISORDERS OF THE MUSCULO-SKELETAL SYSTEM
M09AA Quinine and derivatives
M09AA01 Hydroquinine
D08267 Hydroquinine
BRITE hierarchy
Other DBs
LinkDB
All DBs
KCF data
Show ATOM 24
1 C8y C 20.8600 -20.8600
2 C8x C 20.8600 -22.2600
3 C8x C 22.0500 -22.9600
4 C8x C 22.0500 -20.1600
5 C8y C 23.3100 -20.8600
6 C8y C 23.3100 -22.2600
7 N5x N 24.5000 -22.9600
8 C8x C 25.6900 -22.3300
9 C8x C 25.6900 -20.8600
10 C8y C 24.5000 -20.1600
11 C1c C 24.5000 -18.7600
12 C1y C 25.6900 -18.0600
13 O2a O 19.6700 -20.1600
14 N1y N 27.1600 -17.2200
15 C1x C 27.1600 -15.9600
16 C1x C 28.7000 -18.0600
17 C1y C 26.3900 -16.2400
18 C1y C 26.4600 -15.2600
19 C1x C 28.0000 -16.9400
20 C1b C 25.9000 -13.9300
21 C1x C 24.9900 -17.0800
22 C1a C 26.7400 -12.8800
23 C1a C 19.6700 -18.7600
24 O1a O 23.2847 -18.0649
BOND 27
1 9 10 2
2 10 5 1
3 10 11 1
4 1 2 1
5 12 14 1
6 11 12 1
7 2 3 2
8 3 6 1
9 5 4 1
10 4 1 2
11 5 6 2
12 6 7 1
13 14 15 1
14 14 16 1
15 21 17 1
16 15 18 1
17 16 19 1
18 18 20 1 #Up
19 17 18 1
20 17 19 1
21 1 13 1
22 12 21 1
23 7 8 2
24 20 22 1
25 13 23 1
26 8 9 1
27 11 24 1 #Up