| Entry |
|
|---|
| Name |
Trolnitrate phosphate (JAN);
Nitretamin (TN) |
|---|
| Formula |
C6H12N4O9. 2H3PO4
|
|---|
| Exact mass |
480.0142
|
|---|
| Mol weight |
480.17
|
|---|
| Structure |
|
|---|
| Class |
Cardiovascular agent
DG01657 Nitrovasodilator
|
|---|
| Remark |
|
|---|
| Efficacy |
Vasodilator |
|---|
| Comment |
Organic nitrate
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C01 CARDIAC THERAPY
C01D VASODILATORS USED IN CARDIAC DISEASES
C01DA Organic nitrates
C01DA09 Trolnitrate
D01756 Trolnitrate phosphate (JAN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01657 Nitrovasodilator
D01756 Trolnitrate phosphate
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 29
1 C1b C 16.4048 -19.1597
2 C1b C 17.6148 -19.8602
3 N1c N 18.8247 -19.1668
4 C1b C 20.0347 -19.8673
5 C1b C 21.2446 -19.1738
6 O2a O 22.4545 -19.8743
7 C1b C 18.8278 -17.7659
8 C1b C 20.0426 -17.0679
9 O2a O 20.0457 -15.6669
10 O2a O 15.1906 -19.8587
11 N2b N 21.2606 -14.9692 #+
12 O3a O 21.2636 -13.5682
13 O3a O 22.4722 -15.6724 #-
14 N2b N 23.6687 -19.1753 #+
15 O3a O 23.6704 -17.7744
16 O3a O 24.8810 -19.8772 #-
17 N2b N 13.9783 -19.1568 #+
18 O3a O 12.7641 -19.8558 #-
19 O3a O 13.9798 -17.7558
20 P1b P 29.0229 -17.0722
21 O1c O 30.3348 -17.0841
22 O1c O 27.7939 -17.0841
23 O1c O 29.0820 -18.5030
24 O1c O 29.0582 -15.4456
25 P1b P 29.0229 -17.0722
26 O1c O 30.3348 -17.0841
27 O1c O 27.7939 -17.0841
28 O1c O 29.0820 -18.5030
29 O1c O 29.0582 -15.4456
BOND 26
1 3 7 1
2 14 15 2
3 14 16 1
4 7 8 1
5 10 17 1
6 3 4 1
7 17 18 1
8 8 9 1
9 17 19 2
10 1 2 1
11 1 10 1
12 4 5 1
13 9 11 1
14 11 12 2
15 5 6 1
16 11 13 1
17 2 3 1
18 6 14 1
19 20 21 1
20 20 22 1
21 20 23 1
22 20 24 2
23 25 26 1
24 25 27 1
25 25 28 1
26 25 29 2
BRACKET 1 26.3200 -19.4600 26.3200 -14.6300
1 31.7800 -14.6300 31.7800 -19.4600
1 2
ORIGINAL 1 20 21 22 23 24
REPEAT 1 25 26 27 28 29
|
|---|
