Vitas-M small molecule compound
(4E)-1-benzyl-5-(3-ethoxy-4-propoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK561280
SMILES CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\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 C32H33NO6 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33NO6/c1-4-15-38-26-14-11-22(18-27(26)37-5-2)29-28(30(34)23-12-13-25-24(17-23)16-20(3)39-25)31(35)32(36)33(29)19-21-9-7-6-8-10-21/h6-14,17-18,20,29,34H,4-5,15-16,19H2,1-3H3/b30-28+InChIKey
KWOQPAOUNJQGLP-SJCQXOIGSA-NSynonyms
844830-06-4(4E)1benzyl5(3ethoxy4propoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
844830064
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2CC5=CC=CC=C5)OCC
CCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC32H33NO6c14153826141122(1827(26)3752)2928(30(34)2312132524(1723)1620(3)3925)31(35)32(36)33(29)192197681021h6141718202934H45151619H213H3b3028+
MFCD04074058
ZINC000102502725
ZINC000102643854
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