Vitas-M small molecule compound
(E)-1-benzofuran-2-yl{1-[3-(diethylammonio)propyl]-2-(2,5-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK562336
SMILES COc1ccc(c(c1)C1N(CCC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-])OC
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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 C28H32N2O6 MW 492.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O6/c1-5-29(6-2)14-9-15-30-25(20-17-19(34-3)12-13-22(20)35-4)24(27(32)28(30)33)26(31)23-16-18-10-7-8-11-21(18)36-23/h7-8,10-13,16-17,25,31H,5-6,9,14-15H2,1-4H3/b26-24+InChIKey
KTKKGMSUZATHSG-SHHOIMCASA-NSynonyms
(E)1benzofuran2yl(1(3(diethylammonio)propyl)2(25dimethoxyphenyl)45dioxopyrrolidin3ylidene)methanolateCOc1ccc(c(c1)C1N(CCC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1cc2c(o1)cccc2)(O))OC
Registry IDs
MFCD18244024ZINC000009184920
ZINC000009184921
Check stock
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Check stock on Vitas-MAvailable files
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