Vitas-M small molecule compound
(2Z)-7-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STL514575
SMILES COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCN(CC1)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 C24H28N2O6 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O6/c1-25-9-11-26(12-10-25)14-17-18(27)7-6-16-21(28)20(32-23(16)17)13-15-5-8-19(29-2)24(31-4)22(15)30-3/h5-8,13,27H,9-12,14H2,1-4H3/b20-13-InChIKey
KNUWKHZMKHXHJW-MOSHPQCFSA-NSynonyms
859662-39-8(2~(Z))7((4methylpiperazin1ium1yl)methyl)3oxo2((234trimethoxyphenyl)methylidene)1benzofuran6olate
(2Z)7((4methylpiperazin1ium1yl)methyl)3oxo2(234trimethoxybenzylidene)23dihydro1benzofuran6olate
29094090
859662398
MFCD06494613
ZINC000020611247
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