Vitas-M small molecule compound
(1Z,2E)-1-{2-(4-ethylphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}-3-phenylprop-2-en-1-olate
Catalog ID
STK598137
SMILES CCc1ccc(cc1)C1/C(=C(\C=C\c2ccccc2)/[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 C28H32N2O4 MW 460.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O4/c1-2-21-9-12-23(13-10-21)26-25(24(31)14-11-22-7-4-3-5-8-22)27(32)28(33)30(26)16-6-15-29-17-19-34-20-18-29/h3-5,7-14,26,31H,2,6,15-20H2,1H3/b14-11+,25-24-InChIKey
XDEFRNBFAMKDRD-HQLZGKKESA-NSynonyms
(1Z2E)1(2(4ethylphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)3phenylprop2en1olate
CCc1ccc(cc1)C1C(=C(C=Cc2ccccc2)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
MFCD07201782
ZINC000020171771
ZINC000020171773
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