Vitas-M small molecule compound
2-methyl-4-oxo-3-(1,3-thiazol-4-yl)-4H-chromen-7-yl 2,3,4,6-tetra-O-acetyl-beta-D-glucopyranoside
Catalog ID
STL565426
SMILES CC(=O)OC[C@H]1O[C@@H](Oc2ccc3c(c2)oc(c(c3=O)c2cscn2)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=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 C27H27NO12S MW 589.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO12S/c1-12-22(19-10-41-11-28-19)23(33)18-7-6-17(8-20(18)35-12)39-27-26(38-16(5)32)25(37-15(4)31)24(36-14(3)30)21(40-27)9-34-13(2)29/h6-8,10-11,21,24-27H,9H2,1-5H3/t21-,24-,25+,26-,27-/m1/s1InChIKey
QLPBVUOEXHYSIY-BYBMWWPSSA-NSynonyms
106508-41-2((2R3R4S5R6S)345triacetyloxy6(2methyl4oxo3(13thiazol4yl)chromen7yl)oxyoxan2yl)methylacetate
(2R3R4S5R6S)2(acetoxymethyl)6((2methyl4oxo3(thiazol4yl)4Hchromen7yl)oxy)tetrahydro2Hpyran345triyltriacetate
106508412
16396022
2methyl4oxo3(13thiazol4yl)4Hchromen7yl2346tetraOacetylbetaDglucopyranoside
CC(=O)OC(C@H)1O(C@@H)(Oc2ccc3c(c2)oc(c(c3=O)c2cscn2)C)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC27H27NO12Sc11222(191041112819)23(33)187617(820(18)3512)392726(3816(5)32)25(3715(4)31)24(3614(3)30)21(4027)93413(2)29h681011212427H9H215H3t212425+2627m1s1
MFCD32651665
ZINC000070665835
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