Vitas-M small molecule compound
(2Z)-7-[(dibutylammonio)methyl]-2-(2-ethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK625629
SMILES CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccccc1OCC)/C2=O)CCCC
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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 C26H33NO4 MW 423.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33NO4/c1-4-7-15-27(16-8-5-2)18-21-22(28)14-13-20-25(29)24(31-26(20)21)17-19-11-9-10-12-23(19)30-6-3/h9-14,17,28H,4-8,15-16,18H2,1-3H3/b24-17-InChIKey
ISWUEGRQTUNYBC-ULJHMMPZSA-NSynonyms
929434-04-8(2Z)7((dibutylammonio)methyl)2(2ethoxybenzylidene)3oxo23dihydro1benzofuran6olate
7((DIBUTYLAMINO)METHYL)2((2ETHOXYPHENYL)METHYLENE)6HYDROXYBENZO(B)FURAN3ONE
CCCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1ccccc1OCC)C2=O)CCCC
MFCD09797490
ZINC000020624956
ZINC20624956
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