Vitas-M small molecule compound
(E)-{2-(3,4-diethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methylfuran-2-yl)methanolate
Catalog ID
STL040173
SMILES CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc(o2)C)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1
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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 C27H34N2O7 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O7/c1-4-34-20-10-8-19(17-22(20)35-5-2)24-23(25(30)21-9-7-18(3)36-21)26(31)27(32)29(24)12-6-11-28-13-15-33-16-14-28/h7-10,17,24,30H,4-6,11-16H2,1-3H3/b25-23+InChIKey
PENCPUIDTKIESG-WJTDDFOZSA-NSynonyms
(E)(2(34diethoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(5methylfuran2yl)methanolate
CCOc1cc(ccc1OCC)C1C(=C(c2ccc(o2)C)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
MFCD18247970
ZINC000009043885
ZINC000009176312
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