Vitas-M small molecule compound
(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-N-[2-(4-methoxyphenyl)ethyl]-4-methylhex-4-enamide
Catalog ID
STL471020
SMILES COc1c(C/C=C(/CCC(=O)NCCc2ccc(cc2)OC)\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 C26H31NO6 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31NO6/c1-16(6-12-22(28)27-14-13-18-7-9-19(31-3)10-8-18)5-11-20-24(29)23-21(15-33-26(23)30)17(2)25(20)32-4/h5,7-10,29H,6,11-15H2,1-4H3,(H,27,28)/b16-5+InChIKey
JXVQEQXTSGFUFH-FZSIALSZSA-NSynonyms
1802378-12-6(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)N(2(4methoxyphenyl)ethyl)4methylhex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)N(4methoxyphenethyl)4methylhex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)N(2(4methoxyphenyl)ethyl)4methylhex4enamide
1802378126
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NCCC3=CC=C(C=C3)OC)OC
COc1c(CC=C(CCC(=O)NCCc2ccc(cc2)OC)C)c(O)c2c(c1C)COC2=O
InChI=1SC26H31NO6c116(61222(28)271413187919(313)10818)5112024(29)2321(153326(23)30)17(2)25(20)324h571029H61115H214H3(H2728)b165+
MFCD18790976
ZINC000062001571
ZINC62001571
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