U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H35O5S.Na
Molecular Weight 410.544
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of SODIUM LINOLEOYL ISETHIONATE

SMILES

[Na+].CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCCS([O-])(=O)=O

InChI

InChIKey=ARJAHCBOXNBNGO-NBTZWHCOSA-M
InChI=1S/C20H36O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(21)25-18-19-26(22,23)24;/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,22,23,24);/q;+1/p-1/b7-6-,10-9-;

HIDE SMILES / InChI

Approval Year

Name Type Language
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, 2-SULFOETHYL ESTER, SODIUM SALT (1:1)
Preferred Name English
SODIUM LINOLEOYL ISETHIONATE
Systematic Name English
Code System Code Type Description
FDA UNII
G3XE42P81Y
Created by admin on Mon Mar 31 19:17:11 GMT 2025 , Edited by admin on Mon Mar 31 19:17:11 GMT 2025
PRIMARY
PUBCHEM
56841700
Created by admin on Mon Mar 31 19:17:11 GMT 2025 , Edited by admin on Mon Mar 31 19:17:11 GMT 2025
PRIMARY
CAS
1021898-68-9
Created by admin on Mon Mar 31 19:17:11 GMT 2025 , Edited by admin on Mon Mar 31 19:17:11 GMT 2025
PRIMARY