Vitas-M small molecule compound

3,4,6-tri-O-acetyl-1,2-O-[(1S)-1-cyanoethylidene]-alpha-D-glucopyranose

Catalog ID
STL525586
SMILES N#C[C@]1(C)O[C@@H]2[C@H](O1)[C@@H](OC(=O)C)[C@@H]([C@H](O2)COC(=O)C)OC(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H19NO9 MW 357.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19NO9/c1-7(17)20-5-10-11(21-8(2)18)12(22-9(3)19)13-14(23-10)25-15(4,6-16)24-13/h10-14H,5H2,1-4H3/t10-,11-,12+,13-,14-,15+/m1/s1
InChIKey
KKCSJTRPBSCHFU-KYFQHEKYSA-N
Synonyms
61376-15-6
((2~(S)3~(a)~(R)5~(R)6~(R)7~(S)7~(a)~(R))67diacetyloxy2cyano2methyl5677~(a)tetrahydro3~(a)~(H)(13)dioxolo(45b)pyran5yl)methylacetate
(2S3aR5R6R7S7aR)5(acetoxymethyl)2cyano2methyltetrahydro3aH(13)dioxolo(45b)pyran67diyldiacetate
1O2O((S)1CYANOETHYLIDENE)3O4O6OTRIACETYLALPHADGLUCOPYRANOSE
346triOacetyl12O((1S)1cyanoethylidene)alphaDglucopyranose
61376156
7076519
InChI=1SC15H19NO9c17(17)2051011(218(2)18)12(229(3)19)1314(2310)2515(4616)2413h1014H5H214H3t101112+131415+m1s1
MFCD00379038
N#C(C@)1(C)O(C@@H)2(C@H)(O1)(C@@H)(OC(=O)C)(C@@H)((C@H)(O2)COC(=O)C)OC(=O)C
ZINC000004026446
ZINC4026446

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Available files

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