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Details

Stereochemistry ABSOLUTE
Molecular Formula C48H91NO9
Molecular Weight 826.2374
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of LONGAN CEREBROSIDE II

SMILES

CCCCCCCCCCCCCCCCCCCCCC[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)\C=C\CC\C=C/CCCCCCCCC

InChI

InChIKey=WJKBJBJBUDIMHM-YPXPOPQXSA-N
InChI=1S/C48H91NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-42(52)47(56)49-40(39-57-48-46(55)45(54)44(53)43(38-50)58-48)41(51)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h26,28,34,36,40-46,48,50-55H,3-25,27,29-33,35,37-39H2,1-2H3,(H,49,56)/b28-26-,36-34+/t40-,41+,42+,43+,44+,45-,46+,48+/m0/s1

HIDE SMILES / InChI

Molecular Formula C48H91NO9
Molecular Weight 826.2374
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:15:55 GMT 2023
Edited
by admin
on Sat Dec 16 10:15:55 GMT 2023
Record UNII
A2JXP6CCT4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LONGAN CEREBROSIDE II
Common Name English
(2R)-N-((1S,2R,3E,7Z)-1-((.BETA.-D-GLUCOPYRANOSYLOXY)METHYL)-2-HYDROXY-3,7-HEPTADECADIEN-1-YL)-2-HYDROXYTETRACOSANAMIDE
Systematic Name English
1-O-.BETA.-D-GLUCOPYRANOSYL-(2S*,3R*,4E,8Z)-2-N-((2R)-HYDROXYTETRACOSANOYL)OCTADECASPHINGA-4,8-DIENINE
Systematic Name English
GLUCOSYL CERAMIDE, LONGAN CEREBROSIDE II-
Common Name English
TETRACOSANAMIDE, N-((1S,2R,3E,7Z)-1-((.BETA.-D-GLUCOPYRANOSYLOXY)METHYL)-2-HYDROXY-3,7-HEPTADECADIEN-1-YL)-2-HYDROXY-, (2R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
132487837
Created by admin on Sat Dec 16 10:15:56 GMT 2023 , Edited by admin on Sat Dec 16 10:15:56 GMT 2023
PRIMARY
FDA UNII
A2JXP6CCT4
Created by admin on Sat Dec 16 10:15:56 GMT 2023 , Edited by admin on Sat Dec 16 10:15:56 GMT 2023
PRIMARY
CAS
220873-86-9
Created by admin on Sat Dec 16 10:15:56 GMT 2023 , Edited by admin on Sat Dec 16 10:15:56 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT