Vitas-M small molecule compound
(E)-{2-(2,5-dimethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STK563333
SMILES COc1ccc(c(c1)C1/C(=C(/c2ccc(cc2)C)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C)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 C25H30N2O5 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5/c1-16-7-9-17(10-8-16)23(28)21-22(19-15-18(31-4)11-12-20(19)32-5)27(25(30)24(21)29)14-6-13-26(2)3/h7-12,15,22,28H,6,13-14H2,1-5H3/b23-21+InChIKey
NTRPKEYPKMGWGV-XTQSDGFTSA-NSynonyms
615270-86-5(4E)5(25DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(25dimethoxyphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(2(25DIMETHOXYPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
5(25DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
615270865
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=C(C=CC(=C3)OC)OC)O
COc1ccc(c(c1)C1C(=C(c2ccc(cc2)C)(O))C(=O)C(=O)N1CCC(NH+)(C)C)OC
InChI=1SC25H30N2O5c1167917(10816)23(28)2122(191518(314)111220(19)325)27(25(30)24(21)29)1461326(2)3h712152228H61314H215H3b2321+
MFCD18244267
ZINC000102519578
ZINC000102519587
Check stock
See real-time availability and sample size for STK563333 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.