| Entry |
|
|---|
| Name |
Salsalate (USP/INN);
Sasapyrine (JAN);
Disalcid (TN) |
|---|
| Formula |
C14H10O5
|
|---|
| Exact mass |
258.0528
|
|---|
| Mol weight |
258.23
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Anti-inflammatory
DG01504 Nonsteroidal anti-inflammatory drug (NSAID)
DG01909 Anti-inflammatory drug, salicylic acid derivatives
|
|---|
| Remark |
|
|---|
| Efficacy |
Analgesic, Anti-inflammatory, COX inhibitor |
|---|
| Disease |
Rheumatoid arthritis [DS: H00630] |
|---|
| Comment |
Salicylic acid derivative
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N02 ANALGESICS
N02B OTHER ANALGESICS AND ANTIPYRETICS
N02BA Salicylic acid and derivatives
N02BA06 Salsalate
D00428 Salsalate (USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
Designated second-class OTC drugs
Inorganic and organic chemicals
Sasapyrine
D00428 Salsalate (USP/INN)
Second-class OTC drugs
Inorganic and organic chemicals
Sasapyrine
D00428 Salsalate (USP/INN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01504 Nonsteroidal anti-inflammatory drug (NSAID)
DG01909 Anti-inflammatory drug, salicylic acid derivatives
D00428 Salsalate
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
Prostaglandin synthase
PTGS1 (COX1)
D00428 Salsalate (USP/INN)
PTGS2 (COX2)
D00428 Salsalate (USP/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 19
1 C8y C 16.8000 -16.5200
2 C8y C 15.6100 -15.8200
3 O7a O 17.9900 -15.8200
4 C8x C 16.8000 -17.9200
5 C8x C 14.4200 -16.5200
6 C6a C 15.6100 -14.4200
7 C7a C 19.2500 -16.5200
8 C8x C 15.6100 -18.6200
9 C8x C 14.4200 -17.9200
10 O6a O 14.4200 -13.7900
11 O6a O 16.8000 -13.7200
12 C8y C 20.4400 -15.8200
13 O6a O 19.2500 -17.9200
14 C8y C 21.6300 -16.5200
15 C8x C 20.4400 -14.4200
16 C8x C 22.8900 -15.8200
17 O1a O 21.6300 -17.9200
18 C8x C 21.6300 -13.7200
19 C8x C 22.8900 -14.4200
BOND 20
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 2
8 5 9 2
9 6 10 1
10 6 11 2
11 7 12 1
12 7 13 2
13 12 14 2
14 12 15 1
15 14 16 1
16 14 17 1
17 15 18 2
18 16 19 2
19 8 9 1
20 18 19 1
|
|---|
