Eliglustat N-oxide

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H36N2O5
Molecular Weight	420.5423
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCCCCC(=O)N[C@H](C[N+]1([O-])CCCC1)[C@H](O)C2=CC=C3OCCOC3=C2

InChI

InChIKey=SKLCDAWQWJJXTK-AUSIDOKSSA-N

InChI=1S/C23H36N2O5/c1-2-3-4-5-6-9-22(26)24-19(17-25(28)12-7-8-13-25)23(27)18-10-11-20-21(16-18)30-15-14-29-20/h10-11,16,19,23,27H,2-9,12-15,17H2,1H3,(H,24,26)/t19-,23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C23H36N2O5
Molecular Weight	420.5423
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:48:08 GMT 2023` Edited by `admin` on `Sat Dec 16 19:48:08 GMT 2023`
Record UNII	CDA5TS6T5T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Eliglustat N-oxide

Common Name

English

1-[(2R,3R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-hydroxy-2-octanamidopropyl]pyrrolidin-1-ium-1-olate

Systematic Name

English

Octanamide, N-[(1R,2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-[(1-oxido-1-pyrrolidinyl)methyl]ethyl]-

Systematic Name

English

N-[(1R,2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-[(1-oxido-1-pyrrolidinyl)methyl]ethyl]octanamide

Systematic Name

English

Code System Code Type Description

FDA UNII

CDA5TS6T5T

Created by admin on Sat Dec 16 19:48:08 GMT 2023 , Edited by admin on Sat Dec 16 19:48:08 GMT 2023

PRIMARY

PUBCHEM

146080996

Created by admin on Sat Dec 16 19:48:08 GMT 2023 , Edited by admin on Sat Dec 16 19:48:08 GMT 2023

PRIMARY

CAS

2137145-62-9

Created by admin on Sat Dec 16 19:48:08 GMT 2023 , Edited by admin on Sat Dec 16 19:48:08 GMT 2023

PRIMARY