Vitas-M small molecule compound
(4E)-N-[2-(furan-2-yl)ethyl]-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide
Catalog ID
STL473312
SMILES COc1c(C/C=C(/CCC(=O)NCCc2ccco2)\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 C23H27NO6 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO6/c1-14(7-9-19(25)24-11-10-16-5-4-12-29-16)6-8-17-21(26)20-18(13-30-23(20)27)15(2)22(17)28-3/h4-6,12,26H,7-11,13H2,1-3H3,(H,24,25)/b14-6+InChIKey
HGWCBQKHMSQCQE-MKMNVTDBSA-NSynonyms
1574537-54-4(4E)N(2(furan2yl)ethyl)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enamide
(E)N(2(furan2yl)ethyl)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylhex4enamide
(E)N(2(furan2yl)ethyl)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)4methylhex4enamide
1574537544
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NCCC3=CC=CO3)OC
COc1c(CC=C(CCC(=O)NCCc2ccco2)C)c(O)c2c(c1C)COC2=O
InChI=1SC23H27NO6c114(7919(25)2411101654122916)681721(26)2018(133023(20)27)15(2)22(17)283h461226H71113H213H3(H2425)b146+
MFCD28051056
ZINC000096114582
ZINC96114582
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