Vitas-M small molecule compound
(4E)-1-benzyl-5-(4-butoxy-3-methoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL041489
SMILES CCCCOc1ccc(cc1OC)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/c1-3-4-14-37-23-12-10-21(17-25(23)36-2)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
CTGVJCDZRFLDMC-ORIPQNMZSA-NSynonyms
618856-38-5(4E)1benzyl5(4butoxy3methoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
618856385
CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5)OC
CCCCOc1ccc(cc1OC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC31H31NO7c134143723121021(1725(23)362)2827(29(33)2211132426(1822)3916153824)30(34)31(35)32(28)19208657920h51317182833H34141619H212H3b2927+
MFCD05731488
ZINC000102867814
ZINC000102867818
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