Vitas-M small molecule compound
(4E)-1-benzyl-5-[4-(benzyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK568394
SMILES CCOc1cc(ccc1OCc1ccccc1)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 C35H31NO7 MW 577.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H31NO7/c1-2-40-29-19-25(13-15-28(29)43-22-24-11-7-4-8-12-24)32-31(33(37)26-14-16-27-30(20-26)42-18-17-41-27)34(38)35(39)36(32)21-23-9-5-3-6-10-23/h3-16,19-20,32,37H,2,17-18,21-22H2,1H3/b33-31+InChIKey
WWZHAVGWAWFVKL-QOSDPKFLSA-NSynonyms
(4E)1BENZYL4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(3ETHOXY4PHENYLMETHOXYPHENYL)PYRROLIDINE23DIONE
(4E)1benzyl5(4(benzyloxy)3ethoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5)OCC6=CC=CC=C6
CCOc1cc(ccc1OCc1ccccc1)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC35H31NO7c1240291925(131528(29)432224117481224)3231(33(37)2614162730(2026)4218174127)34(38)35(39)36(32)212395361023h31619203237H217182122H21H3b3331+
MFCD05725874
ZINC000102552151
ZINC000102552158
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