Vitas-M small molecule compound
(E)-{2-(3,4-diethoxyphenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(furan-2-yl)methanolate
Catalog ID
STL148507
SMILES CCOc1cc(ccc1OCC)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 C25H27N3O6 MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O6/c1-3-32-18-9-8-17(15-20(18)33-4-2)22-21(23(29)19-7-5-14-34-19)24(30)25(31)28(22)12-6-11-27-13-10-26-16-27/h5,7-10,13-16,22,29H,3-4,6,11-12H2,1-2H3/b23-21+InChIKey
GWLCUECTNXWUAS-XTQSDGFTSA-NSynonyms
(E)(2(34diethoxyphenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(furan2yl)methanolate
CCOc1cc(ccc1OCC)C1C(=C(c2ccco2)(O))C(=O)C(=O)N1CCCn1cc(nH+)c1
MFCD20755410
ZINC000102927323
ZINC000102927326
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