Vitas-M small molecule compound
(E)-[4-(benzyloxy)-2-methylphenyl]{1-[3-(dimethylammonio)propyl]-2-(3-ethoxy-4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK564363
SMILES CCOc1cc(ccc1O)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1C)OCc1ccccc1)/[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 C32H36N2O6 MW 544.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H36N2O6/c1-5-39-27-19-23(12-15-26(27)35)29-28(31(37)32(38)34(29)17-9-16-33(3)4)30(36)25-14-13-24(18-21(25)2)40-20-22-10-7-6-8-11-22/h6-8,10-15,18-19,29,35-36H,5,9,16-17,20H2,1-4H3/b30-28+InChIKey
WVFCFHYPMBELKA-SJCQXOIGSA-NSynonyms
488103-51-1(4E)1(3(DIMETHYLAMINO)PROPYL)5(3ETHOXY4HYDROXYPHENYL)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3ETHOXY4HYDROXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)2methylphenyl)(1(3(dimethylammonio)propyl)2(3ethoxy4hydroxyphenyl)45dioxopyrrolidin3ylidene)methanolate
488103511
CCOC1=C(C=CC(=C1)C2C(=C(C3=C(C=C(C=C3)OCC4=CC=CC=C4)C)(O))C(=O)C(=O)N2CCC(NH+)(C)C)O
CCOc1cc(ccc1O)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(cc1C)OCc1ccccc1)(O)
InChI=1SC32H36N2O6c1539271923(121526(27)35)2928(31(37)32(38)34(29)1791633(3)4)30(36)25141324(1821(25)2)402022107681122h6810151819293536H59161720H214H3b3028+
MFCD18244519
ZINC000102527455
ZINC000102527461
Check stock
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