Vitas-M small molecule compound
(4E)-1-benzyl-5-(3,4-diethoxyphenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL041649
SMILES CCOc1cc(ccc1OCC)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 C30H29NO7 MW 515.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO7/c1-3-35-22-12-10-20(16-24(22)36-4-2)27-26(28(32)21-11-13-23-25(17-21)38-15-14-37-23)29(33)30(34)31(27)18-19-8-6-5-7-9-19/h5-13,16-17,27,32H,3-4,14-15,18H2,1-2H3/b28-26+InChIKey
HGXQUWZDEYZQMA-BYCLXTJYSA-NSynonyms
618856-51-2(4E)1benzyl5(34diethoxyphenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)pyrrolidine23dione
618856512
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CC5=CC=CC=C5)OCC
CCOc1cc(ccc1OCC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1Cc1ccccc1
InChI=1SC30H29NO7c133522121020(1624(22)3642)2726(28(32)2111132325(1721)3815143723)29(33)30(34)31(27)18198657919h51316172732H34141518H212H3b2826+
MFCD05737042
ZINC000102867830
ZINC000102867832
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