DOCUSATE CALCIUM

Details

Stereochemistry	MIXED
Molecular Formula	2C20H37O7S.Ca
Molecular Weight	883.215
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Ca++].CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S([O-])(=O)=O.CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S([O-])(=O)=O

InChI

InChIKey=DWKPZOZZBLWFJX-UHFFFAOYSA-L

InChI=1S/2C20H38O7S.Ca/c2*1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2;/h2*16-18H,5-15H2,1-4H3,(H,23,24,25);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	C20H37O7S
Molecular Weight	421.569
Charge	-1
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	Ca
Molecular Weight	40.078
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 05:07:40 UTC 2023` Edited by `admin` on `Sat Dec 16 05:07:40 UTC 2023`
Record UNII	6K7YS503HC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DOCUSATE CALCIUM

Official Name

English

DOCUSATE CALCIUM [USAN]

Common Name

English

1,4-Bis(2-ethylhexyl) sulfosuccinate, calcium salt

Common Name

English

DOCUSATE CALCIUM [MI]

Common Name

English

DOCUSATE CALCIUM [MART.]

Common Name

English

BUTANEDIOIC ACID, SULFO-, 1,4-BIS(2-ETHYLHEXYL) ESTER, CALCIUM SALT

Common Name

English

DIOCTYL CALCIUM SULFOSUCCINATE

Systematic Name

English

Docusate calcium [WHO-DD]

Common Name

English

DOCUSATE CALCIUM [USP MONOGRAPH]

Common Name

English

SURFAK

Brand Name

English

DOCUSATE CALCIUM [VANDF]

Common Name

English

DOCUSATE CALCIUM [USP-RS]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29699