Vitas-M small molecule compound

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(4-ethoxy-3-methoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione

Catalog ID
STL053630
SMILES CCOc1ccc(cc1OC)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 C30H29NO7 MW 515.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO7/c1-3-36-22-11-9-20(17-24(22)35-2)27-26(28(32)21-10-12-23-25(18-21)38-16-15-37-23)29(33)30(34)31(27)14-13-19-7-5-4-6-8-19/h4-12,17-18,27,32H,3,13-16H2,1-2H3/b28-26+
InChIKey
UPDYDUHSISIUJJ-BYCLXTJYSA-N
Synonyms
577763-44-1
(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)5(4ethoxy3methoxyphenyl)1(2phenylethyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)5(4ETHOXY3METHOXYPHENYL)1PHENETHYLPYRROLIDINE23DIONE
577763441
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCC5=CC=CC=C5)OC
CCOc1ccc(cc1OC)C1C(=C(c2ccc3c(c2)OCCO3)O)C(=O)C(=O)N1CCc1ccccc1
InChI=1SC30H29NO7c13362211920(1724(22)352)2726(28(32)2110122325(1821)3816153723)29(33)30(34)31(27)1413197546819h41217182732H31316H212H3b2826+
MFCD05725690
ZINC000102891581
ZINC000102891583

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Available files

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