U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C40H75NO9
Molecular Weight 714.0248
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of SOYACEREBROSIDE I

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)\C=C\CC\C=C\CCCCCCCCC

InChI

InChIKey=HOMYIYLRRDTKAA-HIMJKWBMSA-N
InChI=1S/C40H75NO9/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/h19-20,26,28,32-38,40,42-47H,3-18,21-25,27,29-31H2,1-2H3,(H,41,48)/b20-19+,28-26+/t32-,33+,34+,35+,36+,37-,38+,40+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SOYACEREBROSIDE I
Common Name English
HEXADECANAMIDE, N-((1S,2R,3E,7E)-1-((.BETA.-D-GLUCOPYRANOSYLOXY)METHYL)-2-HYDROXY-3,7-HEPTADECADIEN-1-YL)-2-HYDROXY-, (2R)-
Systematic Name English
(2S,3R,4E,8E)-1-O-.BETA.-D-GLUCOPYRANOSYL-3-HYDROXY-2-(2'R-HYDROXYPALMITOYLAMINO)-4,8-OCTADECADIENE
Systematic Name English
GLUCOSYL CERAMIDE, SOYACEREBROSIDE I-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID401316286
Created by admin on Sat Dec 16 10:15:54 GMT 2023 , Edited by admin on Sat Dec 16 10:15:54 GMT 2023
PRIMARY
FDA UNII
OVF1RF8S49
Created by admin on Sat Dec 16 10:15:54 GMT 2023 , Edited by admin on Sat Dec 16 10:15:54 GMT 2023
PRIMARY
PUBCHEM
11104507
Created by admin on Sat Dec 16 10:15:54 GMT 2023 , Edited by admin on Sat Dec 16 10:15:54 GMT 2023
PRIMARY
CAS
114297-20-0
Created by admin on Sat Dec 16 10:15:54 GMT 2023 , Edited by admin on Sat Dec 16 10:15:54 GMT 2023
PRIMARY