Vitas-M small molecule compound
(4E)-5-(3,4-diethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-phenylethyl)pyrrolidine-2,3-dione
Catalog ID
STL054648
SMILES CCOc1cc(ccc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1CCc1ccccc1
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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 C31H31NO7 MW 529.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO7/c1-3-36-23-12-10-21(18-25(23)37-4-2)28-27(29(33)22-11-13-24-26(19-22)39-17-16-38-24)30(34)31(35)32(28)15-14-20-8-6-5-7-9-20/h5-13,18-19,28,33H,3-4,14-17H2,1-2H3/b29-27+InChIKey
BUQRAQUJSAWRCO-ORIPQNMZSA-NSynonyms
587011-47-0(4E)5(34diethoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(2phenylethyl)pyrrolidine23dione
(4E)5(34DIETHOXYPHENYL)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1PHENETHYLPYRROLIDINE23DIONE
587011470
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCC5=CC=CC=C5)OCC
CCOc1cc(ccc1OCC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1CCc1ccccc1
InChI=1SC31H31NO7c133623121021(1825(23)3742)2827(29(33)2211132426(1922)3917163824)30(34)31(35)32(28)1514208657920h51318192833H341417H212H3b2927+
MFCD05732052
ZINC000102894018
ZINC000102894020
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