BUTYLDIMONIUMHYDROXYPROPYL BUTYLGLUCOSIDE CHLORIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C19H40NO7.Cl
Molecular Weight	429.976
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUTYLDIMONIUMHYDROXYPROPYL BUTYLGLUCOSIDE CHLORIDE

Structure Search

SMILES

[Cl-].CCCCO[C@@H]1O[C@H](COCC(O)C[N+](C)(C)CCCC)[C@@H](O)[C@H](O)[C@H]1O

InChI

InChIKey=VQRDHZQHQPJMQF-WEBVRNPGSA-M

InChI=1S/C19H40NO7.ClH/c1-5-7-9-20(3,4)11-14(21)12-25-13-15-16(22)17(23)18(24)19(27-15)26-10-8-6-2;/h14-19,21-24H,5-13H2,1-4H3;1H/q+1;/p-1/t14?,15-,16-,17+,18-,19-;/m1./s1

HIDE SMILES / InChI

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

Molecular Formula	C19H39NO7
Molecular Weight	393.5155
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:36:03 GMT 2023` Edited by `admin` on `Sat Dec 16 10:36:03 GMT 2023`
Record UNII	XO3463EH1X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUTYLDIMONIUMHYDROXYPROPYL BUTYLGLUCOSIDE CHLORIDE

Common Name

English

N-(3-(((2R,3S,4S,5R,6R)-6-BUTOXY-3,4,5-TRIHYDROXYTETRAHYDRO-2H-PYRAN-2-YL)METHOXY)-2-HYDROXYPROPYL)-N,N-DIMETHYLBUTAN-1-AMINIUM CHLORIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

139033239

Created by admin on Sat Dec 16 10:36:03 GMT 2023 , Edited by admin on Sat Dec 16 10:36:03 GMT 2023

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FDA UNII

XO3463EH1X

Created by admin on Sat Dec 16 10:36:03 GMT 2023 , Edited by admin on Sat Dec 16 10:36:03 GMT 2023

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