Vitas-M small molecule compound
(4E)-5-(3-butoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(2-phenylethyl)pyrrolidine-2,3-dione
Catalog ID
STL053372
SMILES CCCCOc1cccc(c1)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 C31H31NO6 MW 513.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31NO6/c1-2-3-16-36-24-11-7-10-22(19-24)28-27(29(33)23-12-13-25-26(20-23)38-18-17-37-25)30(34)31(35)32(28)15-14-21-8-5-4-6-9-21/h4-13,19-20,28,33H,2-3,14-18H2,1H3/b29-27+InChIKey
FEWVCGGDLQKRFT-ORIPQNMZSA-NSynonyms
618856-17-0(4E)5(3butoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(2phenylethyl)pyrrolidine23dione
(4E)5(3BUTOXYPHENYL)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1PHENETHYLPYRROLIDINE23DIONE
618856170
CCCCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCC5=CC=CC=C5
CCCCOc1cccc(c1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1CCc1ccccc1
InChI=1SC31H31NO6c1231636241171022(1924)2827(29(33)2312132526(2023)3818173725)30(34)31(35)32(28)1514218546921h41319202833H231418H21H3b2927+
MFCD05737325
ZINC000102890862
ZINC000102890864
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