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

Details

Stereochemistry RACEMIC
Molecular Formula C15H29O5S.Na
Molecular Weight 344.443
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM LAUROYL 1-METHYL ISETHIONATE

SMILES

[Na+].CCCCCCCCCCCC(=O)OCC(C)S([O-])(=O)=O

InChI

InChIKey=KUYWMPRATIWRDK-UHFFFAOYSA-M
InChI=1S/C15H30O5S.Na/c1-3-4-5-6-7-8-9-10-11-12-15(16)20-13-14(2)21(17,18)19;/h14H,3-13H2,1-2H3,(H,17,18,19);/q;+1/p-1

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 C15H29O5S
Molecular Weight 321.453
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:43:33 GMT 2023
Edited
by admin
on Sat Dec 16 01:43:33 GMT 2023
Record UNII
8D813TG5U5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM LAUROYL 1-METHYL ISETHIONATE
Common Name English
DODECANOIC ACID, 2-SULFOPROPYL ESTER, SODIUM SALT (1:1)
Common Name English
SODIUM 1-(DODECANOYLOXY)PROPANE-2-SULFONATE
Systematic Name English
SODIUM LAUROYL 1-METHYL ISETHIONATE, (±)-
Common Name English
(±)-SODIUM LAUROYL 1-METHYL ISETHIONATE
Common Name English
Code System Code Type Description
PUBCHEM
71587898
Created by admin on Sat Dec 16 01:43:33 GMT 2023 , Edited by admin on Sat Dec 16 01:43:33 GMT 2023
PRIMARY
CAS
956749-79-4
Created by admin on Sat Dec 16 01:43:33 GMT 2023 , Edited by admin on Sat Dec 16 01:43:33 GMT 2023
PRIMARY
FDA UNII
8D813TG5U5
Created by admin on Sat Dec 16 01:43:33 GMT 2023 , Edited by admin on Sat Dec 16 01:43:33 GMT 2023
PRIMARY
RXCUI
1370732
Created by admin on Sat Dec 16 01:43:33 GMT 2023 , Edited by admin on Sat Dec 16 01:43:33 GMT 2023
PRIMARY RxNorm
DAILYMED
8D813TG5U5
Created by admin on Sat Dec 16 01:43:33 GMT 2023 , Edited by admin on Sat Dec 16 01:43:33 GMT 2023
PRIMARY