Vitas-M small molecule compound
(4E)-5-(3-ethoxy-4-propoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(3-methoxypropyl)pyrrolidine-2,3-dione
Catalog ID
STL151081
SMILES COCCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(c(c1)OCC)OCCC
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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 C29H35NO7 MW 509.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO7/c1-5-13-36-23-11-8-19(17-24(23)35-6-2)26-25(28(32)29(33)30(26)12-7-14-34-4)27(31)20-9-10-22-21(16-20)15-18(3)37-22/h8-11,16-18,26,31H,5-7,12-15H2,1-4H3/b27-25+InChIKey
DPQAWCGHLWJFFB-IMVLJIQESA-NSynonyms
845651-09-4(4E)5(3ethoxy4propoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(3methoxypropyl)pyrrolidine23dione
845651094
CCCOC1=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)OCCC
InChI=1SC29H35NO7c1513362311819(1724(23)3562)2625(28(32)29(33)30(26)12714344)27(31)209102221(1620)1518(3)3722h81116182631H571215H214H3b2725+
MFCD04078812
ZINC000102933427
ZINC000102933434
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