Vitas-M small molecule compound

(E)-(3,4-dimethoxyphenyl){2-(5-methylfuran-2-yl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate

Catalog ID
STL148718
SMILES COc1ccc(cc1OC)/C(=C/1\C(=O)C(=O)N(C1c1ccc(o1)C)CCC[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 C25H30N2O7 MW 470.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O7/c1-16-5-7-19(34-16)22-21(23(28)17-6-8-18(31-2)20(15-17)32-3)24(29)25(30)27(22)10-4-9-26-11-13-33-14-12-26/h5-8,15,22,28H,4,9-14H2,1-3H3/b23-21+
InChIKey
SDVZXQBKGZOESP-XTQSDGFTSA-N
Synonyms
615271-49-3
(4E)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)5(5METHYLFURAN2YL)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(34dimethoxyphenyl)(2(5methylfuran2yl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(34DIMETHOXYPHENYL)(2(5METHYLFURAN2YL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4((34DIMETHOXYPHENYL)CARBONYL)3HYDROXY5(5METHYL(2FURYL))1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
4(34DIMETHOXYBENZOYL)3HYDROXY5(5METHYL2FURYL)1(3(4MORPHOLINYL)PROPYL)15DIHYDRO2HPYRROL2ONE
615271493
CC1=CC=C(O1)C2C(=C(C3=CC(=C(C=C3)OC)OC)(O))C(=O)C(=O)N2CCC(NH+)4CCOCC4
COc1ccc(cc1OC)C(=C1C(=O)C(=O)N(C1c1ccc(o1)C)CCC(NH+)1CCOCC1)(O)
InChI=1SC25H30N2O7c1165719(3416)2221(23(28)176818(312)20(1517)323)24(29)25(30)27(22)104926111333141226h58152228H4914H213H3b2321+
MFCD20755457
ZINC000009302049
ZINC000009302050

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Available files

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