| Entry |
|
|---|
| Name |
Choline salicylate (JAN/USAN/INN);
Arthropan (TN) |
|---|
| Formula |
C7H5O3. C5H14NO
|
|---|
| Exact mass |
241.1314
|
|---|
| Mol weight |
241.28
|
|---|
| Structure |
|
|---|
| Class |
Anti-inflammatory
DG01504 Nonsteroidal anti-inflammatory drug (NSAID)
DG01909 Anti-inflammatory drug, salicylic acid derivatives
|
|---|
| Remark |
|
|---|
| Efficacy |
Analgesic, Anti-inflammatory, COX inhibitor |
|---|
| 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
N02BA03 Choline salicylate
D00810 Choline salicylate (JAN/USAN/INN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01504 Nonsteroidal anti-inflammatory drug (NSAID)
DG01909 Anti-inflammatory drug, salicylic acid derivatives
D00810 Choline salicylate
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
Prostaglandin synthase
PTGS1 (COX1)
D00810 Choline salicylate (JAN/USAN/INN)
PTGS2 (COX2)
D00810 Choline salicylate (JAN/USAN/INN)
|
|---|
| Other DBs |
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| LinkDB |
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|---|
| KCF data |
ATOM 17
1 C8y C 22.3307 -15.6391
2 C8y C 23.5378 -16.3332
3 C8x C 21.1118 -16.3332
4 C6a C 22.3365 -14.2337
5 C8x C 23.5378 -17.7386
6 O1a O 24.7509 -15.6391
7 C8x C 21.1118 -17.7386
8 O6a O 21.1176 -13.5279
9 O6a O 23.5437 -13.5338 #-
10 C8x C 22.3307 -18.4442
11 C1a C 28.0702 -16.1704
12 N1d N 29.2826 -15.4703 #+
13 C1b C 30.4951 -16.1704
14 C1b C 31.7076 -15.4703
15 O1a O 32.9200 -16.1704
16 C1a C 29.2826 -14.0705
17 C1a C 29.2826 -16.8704
BOND 16
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 2
8 4 9 1
9 5 10 2
10 7 10 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 12 16 1
16 12 17 1
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