Vitas-M small molecule compound
(4E)-5-(3,4-diethoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Catalog ID
STK560644
SMILES COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(c(c1)OCC)OCC
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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 C28H33NO7 MW 495.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33NO7/c1-5-34-22-11-8-18(16-23(22)35-6-2)25-24(27(31)28(32)29(25)12-7-13-33-4)26(30)19-9-10-21-20(15-19)14-17(3)36-21/h8-11,15-17,25,30H,5-7,12-14H2,1-4H3/b26-24+InChIKey
OBSCDSMUWGWNKJ-SHHOIMCASA-NSynonyms
848734-93-0(4E)5(34diethoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(3methoxypropyl)pyrrolidine23dione
848734930
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2CCCOC)OCC
COCCCN1C(=O)C(=O)C(=C(c2ccc3c(c2)CC(O3)C)O)C1c1ccc(c(c1)OCC)OCC
InChI=1SC28H33NO7c15342211818(1623(22)3562)2524(27(31)28(32)29(25)12713334)26(30)199102120(1519)1417(3)3621h81115172530H571214H214H3b2624+
MFCD04072362
ZINC000102497677
ZINC000102642854
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