SODIUM METHYL N-(13-CIS-RETINOYL)-L-CYSTEOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H34NO6S.Na
Molecular Weight	487.585
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	4
Charge	0

SHOW SMILES / InChI

Structure of SODIUM METHYL N-(13-CIS-RETINOYL)-L-CYSTEOATE

Structure Search

SMILES

[Na+].COC(=O)[C@H](CS([O-])(=O)=O)NC(=O)\C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C

InChI

InChIKey=UDNDGNMOQGQRJT-GPVFVYNBSA-M

InChI=1S/C24H35NO6S.Na/c1-17(12-13-20-19(3)11-8-14-24(20,4)5)9-7-10-18(2)15-22(26)25-21(23(27)31-6)16-32(28,29)30;/h7,9-10,12-13,15,21H,8,11,14,16H2,1-6H3,(H,25,26)(H,28,29,30);/q;+1/p-1/b10-7+,13-12+,17-9+,18-15-;/t21-;/m0./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	C24H34NO6S
Molecular Weight	464.595
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	4
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 17:56:47 GMT 2023` Edited by `admin` on `Sat Dec 16 17:56:47 GMT 2023`
Record UNII	W2D49SIY40
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SODIUM METHYL N-(13-CIS-RETINOYL)-L-CYSTEOATE

Common Name

English

N-(13-CIS-RETINOYL)-L-CYSTEIC ACID METHYL ESTER SODIUM SALT

Common Name

English

D-ALANINE, N-((13-CIS)-15-OXORETIN-15-YL)-3-SULFO-, 1-METHYL ESTER, SODIUM SALT (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

W2D49SIY40

Created by admin on Sat Dec 16 17:56:47 GMT 2023 , Edited by admin on Sat Dec 16 17:56:47 GMT 2023

PRIMARY

PUBCHEM

154824285

Created by admin on Sat Dec 16 17:56:47 GMT 2023 , Edited by admin on Sat Dec 16 17:56:47 GMT 2023

PRIMARY

CAS

1161832-05-8

Created by admin on Sat Dec 16 17:56:47 GMT 2023 , Edited by admin on Sat Dec 16 17:56:47 GMT 2023

PRIMARY

SMS_ID

100000164217

Created by admin on Sat Dec 16 17:56:47 GMT 2023 , Edited by admin on Sat Dec 16 17:56:47 GMT 2023

PRIMARY

Related Record Type Details


					JO8HHK595G

METHYL N-(13-CIS-RETINOYL)-L-CYSTEOATE

PARENT -> SALT/SOLVATE