MYRISTYLDIMONIUMHYDROXYPROPYL CETYLGLUCOSIDE CHLORIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C41H84NO7.Cl
Molecular Weight	738.561
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of MYRISTYLDIMONIUMHYDROXYPROPYL CETYLGLUCOSIDE CHLORIDE

Structure Search

SMILES

[Cl-].CCCCCCCCCCCCCCCCO[C@@H]1O[C@H](COCC(O)C[N+](C)(C)CCCCCCCCCCCCCC)[C@@H](O)[C@H](O)[C@H]1O

InChI

InChIKey=GRPFEVGCAGFOKM-ZWBCVIQGSA-M

InChI=1S/C41H84NO7.ClH/c1-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-48-41-40(46)39(45)38(44)37(49-41)35-47-34-36(43)33-42(3,4)31-29-27-25-23-21-18-16-14-12-10-8-6-2;/h36-41,43-46H,5-35H2,1-4H3;1H/q+1;/p-1/t36?,37-,38-,39+,40-,41-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C41H83NO7
Molecular Weight	702.1002
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
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 10:17:03 GMT 2023` Edited by `admin` on `Sat Dec 16 10:17:03 GMT 2023`
Record UNII	MOI3KWR7R0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MYRISTYLDIMONIUMHYDROXYPROPYL CETYLGLUCOSIDE CHLORIDE

Common Name

English

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

Systematic Name

English

Code System Code Type Description

FDA UNII

MOI3KWR7R0

Created by admin on Sat Dec 16 10:17:03 GMT 2023 , Edited by admin on Sat Dec 16 10:17:03 GMT 2023

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PUBCHEM

139033124

Created by admin on Sat Dec 16 10:17:03 GMT 2023 , Edited by admin on Sat Dec 16 10:17:03 GMT 2023

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