Vitas-M small molecule compound
(E)-{2-(3,4-diethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Catalog ID
STL046549
SMILES CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc(cc2)OC)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C
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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 C27H34N2O6 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O6/c1-6-34-21-14-11-19(17-22(21)35-7-2)24-23(25(30)18-9-12-20(33-5)13-10-18)26(31)27(32)29(24)16-8-15-28(3)4/h9-14,17,24,30H,6-8,15-16H2,1-5H3/b25-23+InChIKey
YACTXAXKLVFINV-WJTDDFOZSA-NSynonyms
620145-20-2(4E)5(34DIETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34diethoxyphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(4methoxyphenyl)methanolate
(E)(2(34DIETHOXYPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXYPHENYL)METHANOLATE
5(34DIETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
620145202
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC)(O))C(=O)C(=O)N2CCC(NH+)(C)C)OCC
CCOc1cc(ccc1OCC)C1C(=C(c2ccc(cc2)OC)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC27H34N2O6c163421141119(1722(21)3572)2423(25(30)1891220(335)131018)26(31)27(32)29(24)1681528(3)4h914172430H681516H215H3b2523+
MFCD18248871
ZINC000008900261
ZINC000102880705
Check stock
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Check stock on Vitas-MAvailable files
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