| Entry |
|
|---|
| Name |
Xanthinol niacinate (USAN);
Xantinol nicotinate;
Complamin (TN) |
|---|
| Formula |
C13H21N5O4. C6H5NO2
|
|---|
| Exact mass |
434.1914
|
|---|
| Mol weight |
434.45
|
|---|
| Structure |
|
|---|
| Class |
Respiratory system agent
DG01616 Xanthine derivative
DG01614 Xanthine-type vasodilator
|
|---|
| Remark |
|
|---|
| Efficacy |
Vasodilator (peripheral) |
|---|
| Comment |
Xanthine derivative
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C04 PERIPHERAL VASODILATORS
C04A PERIPHERAL VASODILATORS
C04AD Purine derivatives
C04AD02 Xantinol nicotinate
D06334 Xanthinol niacinate (USAN)
Drug groups [BR:br08330]
Respiratory system agent
DG01616 Xanthine derivative
DG01614 Xanthine-type vasodilator
D06334 Xanthinol niacinate
|
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| Other DBs |
|
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| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C8y C 24.3600 -25.3400
2 C8x C 23.1000 -24.6400
3 C8x C 24.3600 -26.7400
4 C6a C 25.5500 -24.6400
5 C8x C 21.9100 -25.4100
6 N5x N 23.1000 -27.5100
7 O6a O 26.7400 -25.3400
8 O6a O 25.5500 -23.2400
9 C8x C 21.9100 -26.8100
10 C8y C 17.7800 -26.6700
11 N4y N 17.7800 -25.2000
12 C8y C 16.5200 -24.5000
13 C8y C 15.3300 -25.2000
14 C8y C 15.3300 -26.6700
15 N4y N 16.5200 -27.3700
16 N4y N 14.0000 -24.7800
17 C8x C 13.1600 -25.9000
18 N5x N 14.0000 -27.0900
19 O5x O 18.9700 -27.3700
20 O5x O 16.5200 -23.1000
21 C1a C 16.5200 -28.7700
22 C1a C 18.9700 -24.5000
23 C1b C 14.0000 -23.3800
24 C1c C 12.7400 -22.6800
25 C1b C 11.5500 -23.3800
26 O1a O 12.7400 -21.2800
27 N1c N 10.3600 -22.6800
28 C1b C 9.1700 -23.3800
29 C1b C 7.9800 -22.6800
30 O1a O 6.7900 -23.3800
31 C1a C 10.3600 -21.2800
BOND 32
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 3 6 1
6 4 7 1
7 4 8 2
8 5 9 1
9 6 9 2
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 2
14 14 15 1
15 10 15 1
16 13 16 1
17 16 17 1
18 17 18 2
19 14 18 1
20 10 19 2
21 12 20 2
22 15 21 1
23 11 22 1
24 16 23 1
25 23 24 1
26 24 25 1
27 24 26 1
28 25 27 1
29 27 28 1
30 28 29 1
31 29 30 1
32 27 31 1
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