Entry |
|
Name |
Docusate sodium (USP); Sodium dioctyl sulfosuccinate (INN); Dioctyl sodium sulfosuccinate (JAN); Colace (TN) |
Formula |
C20H37O7S. Na
|
Exact mass |
444.2158
|
Mol weight |
444.56
|
Structure |

|
Simcomp |
|
Remark |
Therapeutic category: | 1329 |
Product (DG01771): | D00305<JP> |
Product (mixture): | D04406<JP> |
|
Efficacy |
Softener, Surfactant |
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A06 DRUGS FOR CONSTIPATION
A06A DRUGS FOR CONSTIPATION
A06AA Softeners, emollients
A06AA02 Docusate sodium
D00305 Docusate sodium (USP) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
1 Agents affecting nervous system and sensory organs
13 Agents affecting sensory organs
132 Otic and nasal agents
1329 Others
D00305 Docusate sodium (USP); Sodium dioctyl sulfosuccinate (INN); Dioctyl sodium sulfosuccinate (JAN)
Classification of Japanese OTC drugs [BR:br08313]
Agents for digestive organs
17 Cathartics
D00305 Docusate sodium (USP)
Risk category of Japanese OTC drugs [BR:br08312]
Second-class OTC drugs
Inorganic and organic chemicals
Dioctyl sodium sulfosuccinate
D00305 Docusate sodium (USP)
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Other DBs |
|
LinkDB |
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KCF data |
ATOM 29
1 C1c C 21.4510 -17.1305
2 C7a C 22.6556 -17.8179
3 C1b C 20.2399 -17.8179
4 S4a S 21.4510 -15.7365
5 O7a O 23.8602 -17.1305
6 O6a O 22.6556 -19.2118
7 C7a C 19.0353 -17.1305
8 O1d O 20.0444 -15.7239
9 O1d O 22.9269 -15.7177
10 C1b C 25.0649 -17.8179
11 O7a O 17.8306 -17.8179
12 O6a O 19.0353 -15.7365
13 C1c C 26.2697 -17.1305
14 C1b C 16.6258 -17.1305
15 C1b C 27.4744 -17.8179
16 C1b C 26.2697 -15.7365
17 C1c C 15.4212 -17.8179
18 C1b C 28.6790 -17.1305
19 C1a C 27.4744 -15.0365
20 C1b C 14.2165 -17.1305
21 C1b C 15.4212 -19.2118
22 C1b C 29.8900 -17.8179
23 C1b C 13.0119 -17.8179
24 C1a C 14.2165 -19.9120
25 C1a C 31.0947 -17.1305
26 C1b C 11.8009 -17.1305
27 C1a C 10.5962 -17.8179
28 O1d O 21.4480 -14.3503 #-
29 Z Na 21.0700 -12.4600 #+
BOND 27
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 2
8 4 9 2
9 5 10 1
10 7 11 1
11 7 12 2
12 10 13 1
13 11 14 1
14 13 15 1
15 13 16 1
16 14 17 1
17 15 18 1
18 16 19 1
19 17 20 1
20 17 21 1
21 18 22 1
22 20 23 1
23 21 24 1
24 22 25 1
25 23 26 1
26 26 27 1
27 4 28 1
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