2-HYDROXYSTEARAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C25H53N2O2.C2H5O4S
Molecular Weight	538.824
Optical Activity	( + / - )
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-HYDROXYSTEARAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

Structure Search

SMILES

CCOS([O-])(=O)=O.CCCCCCCCCCCCCCCCC(O)C(=O)NCCC[N+](C)(C)CC

InChI

InChIKey=DRQANKXHDMJZAZ-UHFFFAOYSA-N

InChI=1S/C25H52N2O2.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24(28)25(29)26-22-20-23-27(3,4)6-2;1-2-6-7(3,4)5/h24,28H,5-23H2,1-4H3;2H2,1H3,(H,3,4,5)

HIDE SMILES / InChI

Molecular Formula	C2H5O4S
Molecular Weight	125.124
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C25H53N2O2
Molecular Weight	413.7005
Charge	1
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:34:22 GMT 2025` Edited by `admin` on `Mon Mar 31 20:34:22 GMT 2025`
Record UNII	O5L72WEB2A
Record Status	`Validated (UNII)`
Record Version

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Type

Language

2-HYDROXYSTEARAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

Preferred Name

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Code System Code Type Description

FDA UNII

O5L72WEB2A

Created by admin on Mon Mar 31 20:34:22 GMT 2025 , Edited by admin on Mon Mar 31 20:34:22 GMT 2025

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PUBCHEM

139033174

Created by admin on Mon Mar 31 20:34:22 GMT 2025 , Edited by admin on Mon Mar 31 20:34:22 GMT 2025

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