Vitas-M small molecule compound
3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-7-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one
Catalog ID
STL496050
SMILES OCC1OC2C(C(C1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCN(CC1)S(=O)(=O)C)O)OC
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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 C20H28N2O11S MW 504.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2O11S/c1-31-18-13(24)9(7-21-3-5-22(6-4-21)34(2,29)30)11-12(15(18)26)17-19(33-20(11)28)16(27)14(25)10(8-23)32-17/h10,14,16-17,19,23-27H,3-8H2,1-2H3InChIKey
XGWDDHZGWVTALT-UHFFFAOYSA-NSynonyms
(2R3S4S4aR10bS)34810tetrahydroxy2(hydroxymethyl)9methoxy7((4(methylsulfonyl)piperazin1yl)methyl)2344atetrahydropyrano(32c)isochromen6(10bH)one
34810tetrahydroxy2(hydroxymethyl)9methoxy7((4(methylsulfonyl)piperazin1yl)methyl)344a10btetrahydropyrano(32c)isochromen6(2H)one
MFCD31751409
OC(C@H)1O(C@@H)2(C@@H)((C@H)((C@@H)1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCN(CC1)S(=O)(=O)C)O)OC
ZINC000504206871
ZINC000504206874
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