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Details

Stereochemistry ACHIRAL
Molecular Formula C35H72N3O3.CH3O4S
Molecular Weight 694.062
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMYRISTYLAMIDOETHYL HYDROXYETHYLMONIUM METHOSULFATE

SMILES

COS([O-])(=O)=O.CCCCCCCCCCCCCC(=O)NCC[N+](C)(CCO)CCNC(=O)CCCCCCCCCCCCC

InChI

InChIKey=ZBGWKPKKKAVEMN-UHFFFAOYSA-N
InChI=1S/C35H71N3O3.CH4O4S/c1-4-6-8-10-12-14-16-18-20-22-24-26-34(40)36-28-30-38(3,32-33-39)31-29-37-35(41)27-25-23-21-19-17-15-13-11-9-7-5-2;1-5-6(2,3)4/h39H,4-33H2,1-3H3,(H-,36,37,40,41);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula C35H72N3O3
Molecular Weight 582.9645
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula CH3O4S
Molecular Weight 111.097
Charge -1
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 Sat Dec 16 10:12:49 GMT 2023
Edited
by admin
on Sat Dec 16 10:12:49 GMT 2023
Record UNII
AEQ83QGG8J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMYRISTYLAMIDOETHYL HYDROXYETHYLMONIUM METHOSULFATE
Common Name English
2-HYDROXY-N-METHYL-N,N-BIS(2-TETRADECANAMIDOETHYL)ETHAN-1-AMINIUM METHYL SULFATE
Systematic Name English
Code System Code Type Description
PUBCHEM
92135671
Created by admin on Sat Dec 16 10:12:49 GMT 2023 , Edited by admin on Sat Dec 16 10:12:49 GMT 2023
PRIMARY
FDA UNII
AEQ83QGG8J
Created by admin on Sat Dec 16 10:12:49 GMT 2023 , Edited by admin on Sat Dec 16 10:12:49 GMT 2023
PRIMARY