Vitas-M small molecule compound
(E)-{2-(4-ethoxy-3-methoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(furan-2-yl)methanolate
Catalog ID
STL044800
SMILES CCOc1ccc(cc1OC)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1
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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 C24H25N3O6 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O6/c1-3-32-17-8-7-16(14-19(17)31-2)21-20(22(28)18-6-4-13-33-18)23(29)24(30)27(21)11-5-10-26-12-9-25-15-26/h4,6-9,12-15,21,28H,3,5,10-11H2,1-2H3/b22-20+InChIKey
FNGFQSLXNNZNJJ-LSDHQDQOSA-NSynonyms
(E)(2(4ethoxy3methoxyphenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(furan2yl)methanolate
CCOc1ccc(cc1OC)C1C(=C(c2ccco2)(O))C(=O)C(=O)N1CCCn1cc(nH+)c1
MFCD18248490
ZINC000102880968
ZINC000102880972
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