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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H39NO4S
Molecular Weight 377.582
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-METHYL-N-PALMITOYLTAURINE

SMILES

CCCCCCCCCCCCCCCC(=O)N(C)CCS(O)(=O)=O

InChI

InChIKey=VGVRWTPKKMTCFK-UHFFFAOYSA-N
InChI=1S/C19H39NO4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(21)20(2)17-18-25(22,23)24/h3-18H2,1-2H3,(H,22,23,24)

HIDE SMILES / InChI

Molecular Formula C19H39NO4S
Molecular Weight 377.582
Charge 0
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 Fri Dec 15 18:44:50 GMT 2023
Edited
by admin
on Fri Dec 15 18:44:50 GMT 2023
Record UNII
E8C4LHB0S7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-METHYL-N-PALMITOYLTAURINE
Systematic Name English
ETHANESULFONIC ACID, 2-(METHYL(1-OXOHEXADECYL)AMINO)-
Common Name English
PALMITOYL-N-METHYL TAURINE, N-
Common Name English
TAURINE, N-METHYL-N-PALMITOYL-
Systematic Name English
Code System Code Type Description
FDA UNII
E8C4LHB0S7
Created by admin on Fri Dec 15 18:44:50 GMT 2023 , Edited by admin on Fri Dec 15 18:44:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID20241716
Created by admin on Fri Dec 15 18:44:50 GMT 2023 , Edited by admin on Fri Dec 15 18:44:50 GMT 2023
PRIMARY
CAS
95-98-7
Created by admin on Fri Dec 15 18:44:50 GMT 2023 , Edited by admin on Fri Dec 15 18:44:50 GMT 2023
PRIMARY
PUBCHEM
62522
Created by admin on Fri Dec 15 18:44:50 GMT 2023 , Edited by admin on Fri Dec 15 18:44:50 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT