STEARYLDIMONIUMHYDROXYPROPYL LAURYLDIGLUCOSIDE CHLORIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C47H94NO12.Cl
Molecular Weight	900.702
Optical Activity	UNSPECIFIED
Defined Stereocenters	10 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of STEARYLDIMONIUMHYDROXYPROPYL LAURYLDIGLUCOSIDE CHLORIDE

Structure Search

SMILES

[Cl-].CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(O)COC[C@H]1O[C@H](OC[C@H]2O[C@@H](OCCCCCCCCCCCC)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=OXXAUYMYNJXSRC-DEWQXBCGSA-M

InChI=1S/C47H94NO12.ClH/c1-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-48(3,4)33-37(49)34-56-35-38-40(50)42(52)45(55)47(59-38)58-36-39-41(51)43(53)44(54)46(60-39)57-32-30-28-26-24-16-14-12-10-8-6-2;/h37-47,49-55H,5-36H2,1-4H3;1H/q+1;/p-1/t37?,38-,39-,40-,41-,42+,43+,44-,45-,46-,47+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C47H93NO12
Molecular Weight	864.2408
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	10 / 11
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
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 `Sat Dec 16 11:16:32 GMT 2023` Edited by `admin` on `Sat Dec 16 11:16:32 GMT 2023`
Record UNII	3FA8P524MM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

STEARYLDIMONIUMHYDROXYPROPYL LAURYLDIGLUCOSIDE CHLORIDE

Common Name

English

Code System Code Type Description

FDA UNII

3FA8P524MM

Created by admin on Sat Dec 16 11:16:32 GMT 2023 , Edited by admin on Sat Dec 16 11:16:32 GMT 2023

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PUBCHEM

139032831

Created by admin on Sat Dec 16 11:16:32 GMT 2023 , Edited by admin on Sat Dec 16 11:16:32 GMT 2023

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