Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3,4-dimethoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Catalog ID
STK568867
SMILES COc1cc(ccc1OC)C1N(CCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O
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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 C29H27NO7 MW 501.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO7/c1-34-21-10-8-19(16-23(21)35-2)26-25(27(31)20-9-11-22-24(17-20)37-15-14-36-22)28(32)29(33)30(26)13-12-18-6-4-3-5-7-18/h3-11,16-17,26,31H,12-15H2,1-2H3/b27-25+InChIKey
FCCYABGVBOGREO-IMVLJIQESA-NSynonyms
618856-00-1(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(34dimethoxyphenyl)1(2phenylethyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(34DIMETHOXYPHENYL)1PHENETHYLPYRROLIDINE23DIONE
618856001
COC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCC5=CC=CC=C5)OC
COc1cc(ccc1OC)C1N(CCc2ccccc2)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
InChI=1SC29H27NO7c1342110819(1623(21)352)2625(27(31)209112224(1720)3715143622)28(32)29(33)30(26)1312186435718h31116172631H1215H212H3b2725+
MFCD05734361
ZINC000102554688
ZINC000102554694
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