Vitas-M small molecule compound
(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methyl-N-(propan-2-yl)hex-4-enamide
Catalog ID
STL473390
SMILES COc1c(C/C=C(/CCC(=O)NC(C)C)\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 C20H27NO5 MW 361.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO5/c1-11(2)21-16(22)9-7-12(3)6-8-14-18(23)17-15(10-26-20(17)24)13(4)19(14)25-5/h6,11,23H,7-10H2,1-5H3,(H,21,22)/b12-6+InChIKey
SALSFTMCXUXHDC-WUXMJOGZSA-NSynonyms
1574537-39-5(4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylN(propan2yl)hex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)Nisopropyl4methylhex4enamide
(E)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)4methylNpropan2ylhex4enamide
1574537395
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NC(C)C)OC
COc1c(CC=C(CCC(=O)NC(C)C)C)c(O)c2c(c1C)COC2=O
InChI=1SC20H27NO5c111(2)2116(22)9712(3)681418(23)1715(102620(17)24)13(4)19(14)255h61123H710H215H3(H2122)b126+
MFCD28051816
ZINC000096116024
ZINC96116024
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