Vitas-M small molecule compound

(E)-{2-(3,4-diethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(furan-2-yl)methanolate

Catalog ID
STK566072
SMILES CCOc1cc(ccc1OCC)C1/C(=C(/c2ccco2)\[O-])/C(=O)C(=O)N1CC[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 C25H30N2O7 MW 470.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O7/c1-3-32-18-8-7-17(16-20(18)33-4-2)22-21(23(28)19-6-5-13-34-19)24(29)25(30)27(22)10-9-26-11-14-31-15-12-26/h5-8,13,16,22,28H,3-4,9-12,14-15H2,1-2H3/b23-21+
InChIKey
JHEJFTNJLQVSJV-XTQSDGFTSA-N
Synonyms

(E)(2(34diethoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(furan2yl)methanolate
CCOc1cc(ccc1OCC)C1C(=C(c2ccco2)(O))C(=O)C(=O)N1CC(NH+)1CCOCC1
MFCD18244936
ZINC000009008301
ZINC000009069490

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Available files

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