Vitas-M small molecule compound
(2Z)-7-[(2-methylpiperidinium-1-yl)methyl]-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STL530600
SMILES COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCC1C)[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 C25H29NO6 MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO6/c1-15-7-5-6-12-26(15)14-18-19(27)10-9-17-22(28)21(32-24(17)18)13-16-8-11-20(29-2)25(31-4)23(16)30-3/h8-11,13,15,27H,5-7,12,14H2,1-4H3/b21-13-InChIKey
MSEOPMLEOSBVGK-BKUYFWCQSA-NSynonyms
859132-31-3(2~(Z))7((2methylpiperidin1ium1yl)methyl)3oxo2((234trimethoxyphenyl)methylidene)1benzofuran6olate
(2Z)7((2methylpiperidinium1yl)methyl)3oxo2(234trimethoxybenzylidene)23dihydro1benzofuran6olate
44665131
859132313
MFCD06492856
ZINC000020610591
ZINC000020610593
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