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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H49N2O2.CH3O4S
Molecular Weight 508.755
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of RICINOLEAMIDOPROPYLTRIMONIUM METHOSULFATE

SMILES

COS([O-])(=O)=O.CCCCCC[C@@H](O)C\C=C/CCCCCCCC(=O)NCCC[N+](C)(C)C

InChI

InChIKey=OJOKXBOONCXWCY-XCECJLTFSA-N
InChI=1S/C24H48N2O2.CH4O4S/c1-5-6-7-14-18-23(27)19-15-12-10-8-9-11-13-16-20-24(28)25-21-17-22-26(2,3)4;1-5-6(2,3)4/h12,15,23,27H,5-11,13-14,16-22H2,1-4H3;1H3,(H,2,3,4)/b15-12-;/t23-;/m1./s1

HIDE SMILES / InChI

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

Molecular Formula C24H49N2O2
Molecular Weight 397.6581
Charge 1
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:42:04 GMT 2023
Edited
by admin
on Sat Dec 16 01:42:04 GMT 2023
Record UNII
T6ZQP6BJ6J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RICINOLEAMIDOPROPYLTRIMONIUM METHOSULFATE
INCI  
INCI  
Official Name English
REWOQUAT RTM 50
Brand Name English
1-PROPANAMINIUM, 3-(((9Z,12R)-12-HYDROXY-1-OXO-9-OCTADECEN-1-YL)AMINO)-N,N,N-TRIMETHYL-, METHYL SULFATE (1:1)
Common Name English
1-PROPANAMINIUM, 3-(((9Z,12R)-12-HYDROXY-1-OXO-9-OCTADECENYL)AMINO)-N,N,N-TRIMETHYL-, METHYL SULFATE (SALT)
Common Name English
VARISOFT RTM 50
Brand Name English
RICINOLEAMIDOPROPYLTRIMONIUM METHOSULFATE [INCI]
Common Name English
1-PROPANAMINIUM, 3-((12-HYDROXY-1-OXO-9-OCTADECENYL)AMINO)-N,N,N-TRIMETHYL-, (R-(Z))-, METHYL SULFATE (SALT)
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
287-462-9
Created by admin on Sat Dec 16 01:42:04 GMT 2023 , Edited by admin on Sat Dec 16 01:42:04 GMT 2023
PRIMARY
PUBCHEM
56842391
Created by admin on Sat Dec 16 01:42:04 GMT 2023 , Edited by admin on Sat Dec 16 01:42:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID501006074
Created by admin on Sat Dec 16 01:42:04 GMT 2023 , Edited by admin on Sat Dec 16 01:42:04 GMT 2023
PRIMARY
FDA UNII
T6ZQP6BJ6J
Created by admin on Sat Dec 16 01:42:04 GMT 2023 , Edited by admin on Sat Dec 16 01:42:04 GMT 2023
PRIMARY
CAS
85508-38-9
Created by admin on Sat Dec 16 01:42:04 GMT 2023 , Edited by admin on Sat Dec 16 01:42:04 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE