Vitas-M small molecule compound
(E)-{2-(2,5-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STK566179
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cc(OC)ccc1OC)CC[NH+]1CCOCC1)/[O-]
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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/c1-4-36-19-7-5-18(6-8-19)25(30)23-24(21-17-20(33-2)9-10-22(21)34-3)29(27(32)26(23)31)12-11-28-13-15-35-16-14-28/h5-10,17,24,30H,4,11-16H2,1-3H3/b25-23+InChIKey
BPTIFTFNBWTFCS-WJTDDFOZSA-NSynonyms
636990-49-3(4E)5(25DIMETHOXYPHENYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(25dimethoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(2(25DIMETHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
5(25DIMETHOXYPHENYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
5(25DIMETHOXYPHENYL)4(4ETHOXYBENZOYL)3HYDROXY1(2(4MORPHOLINYL)ETHYL)15DIHYDRO2HPYRROL2ONE
636990493
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=C(C=CC(=C4)OC)OC)O
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cc(OC)ccc1OC)CC(NH+)1CCOCC1)(O)
InChI=1SC27H32N2O7c1436197518(6819)25(30)2324(211720(332)91022(21)343)29(27(32)26(23)31)121128131535161428h510172430H41116H213H3b2523+
MFCD18244969
ZINC000102540138
ZINC000102540146
Check stock
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Check stock on Vitas-MAvailable files
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