Vitas-M small molecule compound

(4E)-N-[2-(3,4-dimethoxyphenyl)ethyl]-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enamide

Catalog ID
STL471014
SMILES COc1cc(CCNC(=O)CC/C(=C/Cc2c(OC)c(C)c3c(c2O)C(=O)OC3)/C)ccc1OC

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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 C27H33NO7 MW 483.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33NO7/c1-16(6-9-19-25(30)24-20(15-35-27(24)31)17(2)26(19)34-5)7-11-23(29)28-13-12-18-8-10-21(32-3)22(14-18)33-4/h6,8,10,14,30H,7,9,11-13,15H2,1-5H3,(H,28,29)/b16-6+
InChIKey
CULOCSXJAVCCCF-OMCISZLKSA-N
Synonyms
1282459-92-0
(4E)N(2(34dimethoxyphenyl)ethyl)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enamide
(E)N(2(34dimethoxyphenyl)ethyl)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)4methylhex4enamide
(E)N(34dimethoxyphenethyl)6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylhex4enamide
1282459920
CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)NCCC3=CC(=C(C=C3)OC)OC)OC
COc1cc(CCNC(=O)CCC(=CCc2c(OC)c(C)c3c(c2O)C(=O)OC3)C)ccc1OC
InChI=1SC27H33NO7c116(691925(30)2420(153527(24)31)17(2)26(19)345)71123(29)2813121881021(323)22(1418)334h68101430H79111315H215H3(H2829)b166+
MFCD18790806
ZINC000062001316
ZINC62001316

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Available files

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