Vitas-M small molecule compound
(2Z)-2-(2,4-dimethoxybenzylidene)-7-[(dimethylammonio)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK856366
SMILES COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2C[NH+](C)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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-21(2)11-15-16(22)8-7-14-19(23)18(26-20(14)15)9-12-5-6-13(24-3)10-17(12)25-4/h5-10,22H,11H2,1-4H3/b18-9-InChIKey
IAQHXWPWUVWINL-NVMNQCDNSA-NSynonyms
869077-05-4(2Z)2((24dimethoxyphenyl)methylidene)7((dimethylamino)methyl)6hydroxy1benzofuran3one
(2Z)2(24dimethoxybenzylidene)7((dimethylammonio)methyl)3oxo23dihydro1benzofuran6olate
869077054
CN(C)CC1=C(C=CC2=C1OC(=CC3=C(C=C(C=C3)OC)OC)C2=O)O
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2C(NH+)(C)C)(O)
InChI=1SC20H21NO5c121(2)111516(22)871419(23)18(2620(14)15)9125613(243)1017(12)254h51022H11H214H3b189
MFCD06405715
ZINC000013653683
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