| Entry |
|
|---|
| Name |
Erythrityl tetranitrate (USAN);
Eritrityl tetranitrate (INN);
Cardilate (TN) |
|---|
| Formula |
C4H6N4O12
|
|---|
| Exact mass |
301.9982
|
|---|
| Mol weight |
302.11
|
|---|
| Structure |
|
|---|
| Class |
Cardiovascular agent
DG01657 Nitrovasodilator
|
|---|
| Remark |
|
|---|
| Efficacy |
Vasodilator (coronary), Atrial natriuretic peptide receptor agonist |
|---|
| Comment |
Organic nitrate
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04270 | Vascular smooth muscle contraction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C01 CARDIAC THERAPY
C01D VASODILATORS USED IN CARDIAC DISEASES
C01DA Organic nitrates
C01DA13 Eritrityl tetranitrate
D04051 Erythrityl tetranitrate (USAN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01657 Nitrovasodilator
D04051 Erythrityl tetranitrate
Target-based classification of drugs [BR:br08310]
Enzymes
Lyases (EC4)
Phosphorus-oxygen lyases
NPR
D04051 Erythrityl tetranitrate (USAN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 20
1 C1b C 19.9787 -16.2946
2 C1c C 21.1890 -16.9952
3 C1c C 22.3992 -16.3017
4 C1b C 23.6095 -17.0024
5 O2a O 24.8197 -16.3087
6 N2b N 26.0299 -17.0094 #+
7 O2a O 18.7642 -16.9937
8 O3a O 27.2444 -16.3102 #-
9 N2b N 17.5516 -16.2917 #+
10 O3a O 16.3371 -16.9908 #-
11 O3a O 17.5531 -14.8903
12 O2a O 21.1855 -18.4151
13 O2a O 22.4023 -14.9004
14 N2b N 23.6174 -14.2022 #+
15 O3a O 23.6205 -12.8009
16 O3a O 24.8167 -14.8983 #-
17 O3a O 26.0281 -18.4153
18 N2b N 22.4122 -19.1275 #+
19 O3a O 23.9746 -18.5015 #-
20 O3a O 22.4086 -20.5100
BOND 19
1 7 9 1
2 3 4 1
3 9 10 1
4 9 11 2
5 1 2 1
6 1 7 1
7 4 5 1
8 5 6 1
9 2 3 1
10 6 8 1
11 2 12 1 #Up
12 13 14 1
13 14 15 2
14 3 13 1 #Down
15 14 16 1
16 6 17 2
17 12 18 1
18 18 19 1
19 18 20 2
|
|---|
