Vitas-M small molecule compound
(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-N-(1H-indol-4-yl)-4-methylhex-4-enamide
Catalog ID
STL522786
SMILES COc1c(C/C=C(/CCC(=O)Nc2cccc3c2cc[nH]3)\C)c(O)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 C25H26N2O5 MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5/c1-14(8-10-21(28)27-20-6-4-5-19-16(20)11-12-26-19)7-9-17-23(29)22-18(13-32-25(22)30)15(2)24(17)31-3/h4-7,11-12,26,29H,8-10,13H2,1-3H3,(H,27,28)/b14-7+InChIKey
XCLVTKOECOQCMY-VGOFMYFVSA-NSynonyms
1630907-93-5(~(E))6(4hydroxy6methoxy7methyl3oxo1~(H)2benzofuran5yl)~(N)(1~(H)indol4yl)4methylhex4enamide
(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)N(1Hindol4yl)4methylhex4enamide
(E)6(4HYDROXY6METHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)N(1HINDOL4YL)4METHYLHEX4ENAMIDE
1630907935
91637597
COc1c(CC=C(CCC(=O)Nc2cccc3c2cc(nH)3)C)c(O)c2c(c1C)COC2=O
InChI=1SC25H26N2O5c114(81021(28)27206451916(20)11122619)791723(29)2218(133225(22)30)15(2)24(17)313h4711122629H81013H213H3(H2728)b147+
MFCD28349469
ZINC000217771939
ZINC217771939
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