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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H27N3O6
Molecular Weight 417.4556
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CASIMIROEDINE

SMILES

CN(CCC1=CN(C=N1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C(=O)\C=C\C3=CC=CC=C3

InChI

InChIKey=CSFQQZOIHVWGMN-BBAXEOEJSA-N
InChI=1S/C21H27N3O6/c1-23(17(26)8-7-14-5-3-2-4-6-14)10-9-15-11-24(13-22-15)21-20(29)19(28)18(27)16(12-25)30-21/h2-8,11,13,16,18-21,25,27-29H,9-10,12H2,1H3/b8-7+/t16-,18-,19+,20-,21-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CASIMIROEDINE
MI  
Common Name English
CINNAMAMIDE, N-(2-(1-.BETA.-D-GLUCOPYRANOSYLIMIDAZOL-4-YL)ETHYL)-N-METHYL-
Systematic Name English
2-PROPENAMIDE, N-(2-(1-.BETA.-D-GLUCOPYRANOSYL-1H-IMIDAZOL-4-YL)ETHYL)-N-METHYL-3-PHENYL-, (2E)-
Systematic Name English
NSC-140860
Code English
CASIMIROEDINE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m104
Created by admin on Sat Dec 16 09:00:14 GMT 2023 , Edited by admin on Sat Dec 16 09:00:14 GMT 2023
PRIMARY Merck Index
CAS
1363-32-2
Created by admin on Sat Dec 16 09:00:14 GMT 2023 , Edited by admin on Sat Dec 16 09:00:14 GMT 2023
SUPERSEDED
FDA UNII
577E0U1P0H
Created by admin on Sat Dec 16 09:00:14 GMT 2023 , Edited by admin on Sat Dec 16 09:00:14 GMT 2023
PRIMARY
NSC
140860
Created by admin on Sat Dec 16 09:00:14 GMT 2023 , Edited by admin on Sat Dec 16 09:00:14 GMT 2023
PRIMARY
PUBCHEM
5281818
Created by admin on Sat Dec 16 09:00:14 GMT 2023 , Edited by admin on Sat Dec 16 09:00:14 GMT 2023
PRIMARY
CAS
5853-02-1
Created by admin on Sat Dec 16 09:00:14 GMT 2023 , Edited by admin on Sat Dec 16 09:00:14 GMT 2023
PRIMARY