Vitas-M small molecule compound
(4E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-N-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-methylhex-4-enamide
Catalog ID
STL539649
SMILES COc1c(C/C=C(/CCC(=O)NC2CCOC(C2)(C)C)\C)c(OC)c2c(c1C)COC2=O
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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 C25H35NO6 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35NO6/c1-15(8-10-20(27)26-17-11-12-32-25(3,4)13-17)7-9-18-22(29-5)16(2)19-14-31-24(28)21(19)23(18)30-6/h7,17H,8-14H2,1-6H3,(H,26,27)/b15-7+InChIKey
UKHLKGDSYNFLLB-VIZOYTHASA-NSynonyms
1574537-52-2(~(E))6(46dimethoxy7methyl3oxo1~(H)2benzofuran5yl)~(N)(22dimethyloxan4yl)4methylhex4enamide
(4E)6(46dimethoxy7methyl3oxo13dihydro2benzofuran5yl)N(22dimethyltetrahydro2Hpyran4yl)4methylhex4enamide
(E)6(46DIMETHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)N(22DIMETHYLTETRAHYDRO2HPYRAN4YL)4METHYLHEX4ENAMIDE
1574537522
75464711
COc1c(CC=C(CCC(=O)NC2CCOC(C2)(C)C)C)c(OC)c2c(c1C)COC2=O
InChI=1SC25H35NO6c115(81020(27)261711123225(34)1317)791822(295)16(2)19143124(28)21(19)23(18)306h717H814H216H3(H2627)b157+
MFCD28051827
ZINC000096116042
ZINC000096116043
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