Vitas-M small molecule compound
(4E)-N-(2,4-dimethoxyphenyl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide
Catalog ID
STL471193
SMILES COc1ccc(c(c1)OC)NC(=O)CC/C(=C/Cc1c(O)c2C(=O)OCc2c(c1OC)C)/C
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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 C25H29NO7 MW 455.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO7/c1-14(7-11-21(27)26-19-10-8-16(30-3)12-20(19)31-4)6-9-17-23(28)22-18(13-33-25(22)29)15(2)24(17)32-5/h6,8,10,12,28H,7,9,11,13H2,1-5H3,(H,26,27)/b14-6+InChIKey
CXIQOSSJKXAUPO-MKMNVTDBSA-NSynonyms
1282457-80-0(4E)N(24dimethoxyphenyl)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enamide
(E)N(24dimethoxyphenyl)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylhex4enamide
(E)N(24dimethoxyphenyl)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)4methylhex4enamide
1282457800
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NC3=C(C=C(C=C3)OC)OC)OC
COc1ccc(c(c1)OC)NC(=O)CCC(=CCc1c(O)c2C(=O)OCc2c(c1OC)C)C
InChI=1SC25H29NO7c114(71121(27)261910816(303)1220(19)314)691723(28)2218(133325(22)29)15(2)24(17)325h68101228H791113H215H3(H2627)b146+
MFCD18791132
ZINC000062001761
ZINC62001761
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