Vitas-M small molecule compound
(2Z)-7-{[benzyl(methyl)ammonio]methyl}-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK622141
SMILES COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](Cc1ccccc1)C)[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 C26H25NO5 MW 431.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO5/c1-27(15-17-7-5-4-6-8-17)16-21-22(28)12-11-20-25(29)24(32-26(20)21)13-18-9-10-19(30-2)14-23(18)31-3/h4-14,28H,15-16H2,1-3H3/b24-13-InChIKey
BZSYPDXVCXQZAA-CFRMEGHHSA-NSynonyms
929456-93-9(2Z)7((benzyl(methyl)ammonio)methyl)2(24dimethoxybenzylidene)3oxo23dihydro1benzofuran6olate
2((24DIMETHOXYPHENYL)METHYLENE)6HYDROXY7((METHYLBENZYLAMINO)METHYL)BENZO(B)FURAN3ONE
929456939
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2C(NH+)(Cc1ccccc1)C)(O)
MFCD09796579
ZINC000020649438
ZINC20649438
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