Vitas-M small molecule compound
7-({4-[bis(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one
Catalog ID
STL511430
SMILES OCC1OC2C(C(C1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)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 C32H34F2N2O9 MW 628.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34F2N2O9/c1-43-30-25(38)20(22-23(27(30)40)29-31(45-32(22)42)28(41)26(39)21(15-37)44-29)14-35-10-12-36(13-11-35)24(16-2-6-18(33)7-3-16)17-4-8-19(34)9-5-17/h2-9,21,24,26,28-29,31,37-41H,10-15H2,1H3InChIKey
OMRCJXOKYUNZAT-UHFFFAOYSA-NSynonyms
(2R3S4S4aR10bS)7((4(bis(4fluorophenyl)methyl)piperazin1yl)methyl)34810tetrahydroxy2(hydroxymethyl)9methoxy2344atetrahydropyrano(32c)isochromen6(10bH)one
135637627
7((4(bis(4fluorophenyl)methyl)piperazin1yl)methyl)34810tetrahydroxy2(hydroxymethyl)9methoxy344~(a)10~(b)tetrahydro2~(H)pyrano(32c)isochromen6one
7((4(bis(4fluorophenyl)methyl)piperazin1yl)methyl)34810tetrahydroxy2(hydroxymethyl)9methoxy344a10btetrahydropyrano(32c)isochromen6(2H)one
InChI=1SC32H34F2N2O9c1433025(38)20(2223(27(30)40)2931(4532(22)42)28(41)26(39)21(1537)4429)1435101236(131135)24(162618(33)7316)174819(34)9517h292124262829313741H1015H21H3
MFCD31751398
OC(C@H)1O(C@@H)2(C@@H)((C@H)((C@@H)1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCN(CC1)C(c1ccc(cc1)F)c1ccc(cc1)F)O)OC
ZINC000503983833
ZINC000503983863
Check stock
See real-time availability and sample size for STL511430 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.