Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Catalog ID
STK561845
SMILES Cc1ccc(o1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C
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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 C24H28N2O5 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O5/c1-14-6-8-19(30-14)21-20(23(28)24(29)26(21)11-5-10-25(3)4)22(27)16-7-9-18-17(13-16)12-15(2)31-18/h6-9,13,15,21,27H,5,10-12H2,1-4H3/b22-20+InChIKey
LFFUSSRDWUKBPT-LSDHQDQOSA-NSynonyms
587007-95-2(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(5METHYLFURAN2YL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(5methylfuran2yl)45dioxopyrrolidin3ylidene)(2methyl23dihydro1benzofuran5yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(5METHYLFURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL23DIHYDRO1BENZOFURAN5YL)METHANOLATE
587007952
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CCC(NH+)(C)C)C4=CC=C(O4)C)(O)
Cc1ccc(o1)C1C(=C(c2ccc3c(c2)CC(O3)C)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC24H28N2O5c1146819(3014)2120(23(28)24(29)26(21)1151025(3)4)22(27)16791817(1316)1215(2)3118h6913152127H51012H214H3b2220+
MFCD18243911
ZINC000006160940
ZINC000006428371
Check stock
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Check stock on Vitas-MAvailable files
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