SODIUM CHOLESTERYL SULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H45O4S.Na
Molecular Weight	488.699
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OS([O-])(=O)=O)[C@H](C)CCCC(C)C

InChI

InChIKey=LMPVQXVJTZWENW-KPNWGBFJSA-M

InChI=1S/C27H46O4S.Na/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(31-32(28,29)30)13-15-26(20,4)25(22)14-16-27(23,24)5;/h9,18-19,21-25H,6-8,10-17H2,1-5H3,(H,28,29,30);/q;+1/p-1/t19-,21+,22+,23-,24+,25+,26+,27-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C27H45O4S
Molecular Weight	465.709
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:13:10 UTC 2023` Edited by `admin` on `Fri Dec 15 19:13:10 UTC 2023`
Record UNII	87FG30X25H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM CHOLESTERYL SULFATE

Official Name

English

SODIUM CHOLESTERYL SULPHATE

Common Name

English

SODIUM CHOLESTERYL SULFATE [INCI]

Common Name

English

CHOLESTEROL 3-SULFATE SODIUM SALT

Common Name

English

SODIUM CHOLESTERYL SULFATE [II]

Common Name

English

CHOLESTEROL 3-SULPHATE SODIUM SALT

Common Name

English

5-CHOLESTEN-3.BETA.-OL SULFATE SODIUM SALT

Common Name

English

5-CHOLESTEN-3.BETA.-OL SULPHATE SODIUM SALT

Common Name

English

Code System Code Type Description

RXCUI

1366923