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-5-yl)-4-methylhex-4-enamide
Catalog ID
STL471190
SMILES COc1c(C/C=C(/CCC(=O)Nc2ccc3c(c2)cc[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(5-9-21(28)27-17-6-8-20-16(12-17)10-11-26-20)4-7-18-23(29)22-19(13-32-25(22)30)15(2)24(18)31-3/h4,6,8,10-12,26,29H,5,7,9,13H2,1-3H3,(H,27,28)/b14-4+InChIKey
LMQJCZHJPUYCCT-LNKIKWGQSA-NSynonyms
1282458-52-9(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)N(1Hindol5yl)4methylhex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)N(1Hindol5yl)4methylhex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)N(1Hindol5yl)4methylhex4enamide
1282458529
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NC3=CC4=C(C=C3)NC=C4)OC
COc1c(CC=C(CCC(=O)Nc2ccc3c(c2)cc(nH)3)C)c(O)c2c(c1C)COC2=O
InChI=1SC25H26N2O5c114(5921(28)2717682016(1217)10112620)471823(29)2219(133225(22)30)15(2)24(18)313h46810122629H57913H213H3(H2728)b144+
MFCD18791078
ZINC000062001705
ZINC62001705
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