1-O-.BETA.-GLUCOPYRANOSYL-(2S,3R,8Z)-2-N-((2'R)-HYDROXYPALMITOYL)-8-SPHINGENINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H77NO9
Molecular Weight	716.0407
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 1-O-.BETA.-GLUCOPYRANOSYL-(2S,3R,8Z)-2-N-((2'R)-HYDROXYPALMITOYL)-8-SPHINGENINE

Structure Search

SMILES

CCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)CCCC\C=C/CCCCCCCCC

InChI

InChIKey=NJXYDZDDOCQODQ-FCAPPQLESA-N

InChI=1S/C40H77NO9/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-33(43)32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)41-39(48)34(44)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,32-38,40,42-47H,3-18,21-31H2,1-2H3,(H,41,48)/b20-19-/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C40H77NO9
Molecular Weight	716.0407
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:08:37 GMT 2025` Edited by `admin` on `Mon Mar 31 23:08:37 GMT 2025`
Record UNII	J89NGX3TRN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-O-.BETA.-GLUCOPYRANOSYL-(2S,3R,8Z)-2-N-((2'R)-HYDROXYPALMITOYL)-8-SPHINGENINE

Common Name

English

GLUCOSYL CERAMIDE, 1-O-.BETA.-GLUCOPYRANOSYL-(2S,3R,8Z)-2-N-((2'R)-HYDROXYPALMITOYL)-8-SPHINGENINE-

Preferred Name

English

HEXADECANAMIDE, N-((1S,2R,7Z)-1-((.BETA.-D-GLUCOPYRANOSYLOXY)METHYL)-2-HYDROXY-7-HEPTADECEN-1-YL)-2-HYDROXY-, (2R)-

Systematic Name

English

(2R)-N-((1S,2R,7Z)-1-((.BETA.-D-GLUCOPYRANOSYLOXY)METHYL)-2-HYDROXY-7-HEPTADECEN-1-YL)-2-HYDROXYHEXADECANAMIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

J89NGX3TRN

Created by admin on Mon Mar 31 23:08:37 GMT 2025 , Edited by admin on Mon Mar 31 23:08:37 GMT 2025

PRIMARY

CAS

136599-18-3

Created by admin on Mon Mar 31 23:08:37 GMT 2025 , Edited by admin on Mon Mar 31 23:08:37 GMT 2025

PRIMARY

PUBCHEM

162623606

Created by admin on Mon Mar 31 23:08:37 GMT 2025 , Edited by admin on Mon Mar 31 23:08:37 GMT 2025

PRIMARY

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