Vitas-M small molecule compound
(E)-{2-(2,4-dimethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Catalog ID
STK560430
SMILES COc1ccc(c(c1)OC)C1/C(=C(/c2ccc(cc2)OC)\[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 C27H32N2O7 MW 496.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O7/c1-33-19-7-5-18(6-8-19)25(30)23-24(21-10-9-20(34-2)17-22(21)35-3)29(27(32)26(23)31)12-4-11-28-13-15-36-16-14-28/h5-10,17,24,30H,4,11-16H2,1-3H3/b25-23+InChIKey
WEPUMIZDVAJQHH-WJTDDFOZSA-NSynonyms
488724-32-9(4E)5(24DIMETHOXYPHENYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(24dimethoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4methoxyphenyl)methanolate
(E)(2(24DIMETHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXYPHENYL)METHANOLATE
488724329
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)3CCOCC3)C4=C(C=C(C=C4)OC)OC)(O)
COc1ccc(c(c1)OC)C1C(=C(c2ccc(cc2)OC)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
InChI=1SC27H32N2O7c133197518(6819)25(30)2324(2110920(342)1722(21)353)29(27(32)26(23)31)1241128131536161428h510172430H41116H213H3b2523+
MFCD18243533
ZINC000102495880
ZINC000102495889
Check stock
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Check stock on Vitas-MAvailable files
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