Vitas-M small molecule compound
5-[(2-methylphenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-1-thiohexopyranoside
Catalog ID
STL553750
SMILES CC(=O)OCC1OC(Sc2nnc(n2c2ccccc2)COc2ccccc2C)C(C(C1OC(=O)C)OC(=O)C)NC(=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 C30H34N4O9S MW 626.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O9S/c1-17-11-9-10-14-23(17)40-16-25-32-33-30(34(25)22-12-7-6-8-13-22)44-29-26(31-18(2)35)28(42-21(5)38)27(41-20(4)37)24(43-29)15-39-19(3)36/h6-14,24,26-29H,15-16H2,1-5H3,(H,31,35)InChIKey
OKYFYXJXMVBPKJ-UHFFFAOYSA-NSynonyms
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6((4phenyl5((otolyloxy)methyl)4H124triazol3yl)thio)tetrahydro2Hpyran34diyldiacetate
(5acetamido34diacetyloxy6((5((2methylphenoxy)methyl)4phenyl124triazol3yl)sulfanyl)oxan2yl)methylacetate
5((2methylphenoxy)methyl)4phenyl4H124triazol3yl346triOacetyl2(acetylamino)2deoxy1thiohexopyranoside
71949838
CC(=O)OC(C@H)1O(C@@H)(Sc2nnc(n2c2ccccc2)COc2ccccc2C)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC30H34N4O9Sc117119101423(17)401625323330(34(25)22127681322)442926(3118(2)35)28(4221(5)38)27(4120(4)37)24(4329)153919(3)36h614242629H1516H215H3(H3135)
MFCD31750889
ZINC000504223138
ZINC000504223146
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