General Information of Drug (ID: DMYG4Y2)

Drug Name
Docusate
Synonyms
DOCUSATE; Docusate hydrogen; Dioctyl sulfosuccinic acid; Spolion 8; 1,4-Bis(2-ethylhexyl) sulfosuccinate; 10041-19-7; EINECS 233-124-0; CHEBI:534; 1,4-Bis(2-ethylhexyl) 2-sulphosuccinate; Butanedioic acid, sulfo-, 1,4-bis(2-ethylhexyl) ester; HNSDLXPSAYFUHK-UHFFFAOYSA-N; Butanedionic acid, sulfo-, 1,4-bis(2-ethylhexyl) ester; Butanedioic acid, 2-sulfo-, 1,4-bis(2-ethylhexyl) ester; 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonic acid; Doc-Q-Lace; Dioctylsulfosuccinsaeure; 1-(2-Tolyl)ethanone
Indication
Disease Entry ICD 11 Status REF
Constipation DD91.1 Approved [1]
Affected Organisms
Humans and other mammals
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C20H38O7S
Canonical SMILES
CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O
InChI
InChI=1S/C20H38O7S/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2/h16-18H,5-15H2,1-4H3,(H,23,24,25)
InChIKey
HNSDLXPSAYFUHK-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
11339
ChEBI ID
CHEMBL534
CAS Number
10041-19-7
UNII
M7P27195AG
DrugBank ID
DB11089
TTD ID
D0X4FM
Drug-Molecule Activity Atlas (DMA)NEW Click to Jump to the Detailed DMA Information of This Drug
Drug ADMET Endpoint Profile (DAE)NEW Click to Jump to the Detailed DAE Information of This Drug

References

1 Drugs@FDA. U.S. Food and Drug Administration. U.S. Department of Health & Human Services. 2015