Vitas-M small molecule compound
(E)-1-benzofuran-2-yl{2-(2,5-dimethoxyphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL150387
SMILES COc1ccc(c(c1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-])OC
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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 C25H26N2O6 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O6/c1-26(2)11-12-27-22(17-14-16(31-3)9-10-19(17)32-4)21(24(29)25(27)30)23(28)20-13-15-7-5-6-8-18(15)33-20/h5-10,13-14,22,28H,11-12H2,1-4H3/b23-21+InChIKey
DSETWFAQDSHDDQ-XTQSDGFTSA-NSynonyms
(E)1benzofuran2yl(2(25dimethoxyphenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)methanolate
COc1ccc(c(c1)C1N(CC(NH+)(C)C)C(=O)C(=O)C1=C(c1cc2c(o1)cccc2)(O))OC
MFCD20755814
ZINC000009007972
ZINC000009007973
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