Vitas-M small molecule compound
(4E)-1-benzyl-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STK568966
SMILES CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1Cc1ccccc1
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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/c1-3-14-37-23-12-10-21(17-25(23)36-4-2)28-27(29(33)22-11-13-24-26(18-22)39-16-15-38-24)30(34)31(35)32(28)19-20-8-6-5-7-9-20/h5-13,17-18,28,33H,3-4,14-16,19H2,1-2H3/b29-27+InChIKey
ZICULTWBAQBLQG-ORIPQNMZSA-NSynonyms
575463-30-8(4E)1benzyl4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(3ethoxy4propoxyphenyl)pyrrolidine23dione
575463308
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5)OCC
CCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC31H31NO7c13143723121021(1725(23)3642)2827(29(33)2211132426(1822)3916153824)30(34)31(35)32(28)19208657920h51317182833H34141619H212H3b2927+
MFCD05738033
ZINC000102555205
ZINC000102555216
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