Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxyphenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Catalog ID
STL051634
SMILES COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1cccc(c1)OCC
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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 C25H27NO7 MW 453.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO7/c1-3-31-18-7-4-6-16(14-18)22-21(24(28)25(29)26(22)10-5-11-30-2)23(27)17-8-9-19-20(15-17)33-13-12-32-19/h4,6-9,14-15,22,27H,3,5,10-13H2,1-2H3/b23-21+InChIKey
DNDHOPVMSBKVHU-XTQSDGFTSA-NSynonyms
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(3ethoxyphenyl)1(3methoxypropyl)pyrrolidine23dione
CCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCOC
COCCCN1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1cccc(c1)OCC
InChI=1SC25H27NO7c13311874616(1418)2221(24(28)25(29)26(22)10511302)23(27)17891920(1517)3313123219h46914152227H351013H212H3b2321+
MFCD05732845
ZINC000102889224
ZINC000102889226
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