Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STK562805
SMILES CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)OC(C)C)N(C(=O)C1=O)CCC[NH+](CC)CC)/[O-]
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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 C29H38N2O5 MW 494.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N2O5/c1-6-30(7-2)18-9-19-31-26(21-10-16-24(17-11-21)36-20(4)5)25(28(33)29(31)34)27(32)22-12-14-23(15-13-22)35-8-3/h10-17,20,26,32H,6-9,18-19H2,1-5H3/b27-25+InChIKey
VSSKEZFORUIGDJ-IMVLJIQESA-NSynonyms
636989-08-7(4E)1(3(DIETHYLAMINO)PROPYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)45dioxo2(4(propan2yloxy)phenyl)pyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXO2(4PROPAN2YLOXYPHENYL)PYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(4(METHYLETHOXY)PHENYL)3PYRROLIN2ONE
636989087
CCN(CC)CCCN1C(C(=C(C2=CC=C(C=C2)OCC)O)C(=O)C1=O)C3=CC=C(C=C3)OC(C)C
CCOc1ccc(cc1)C(=C1C(c2ccc(cc2)OC(C)C)N(C(=O)C1=O)CCC(NH+)(CC)CC)(O)
InChI=1SC29H38N2O5c1630(72)189193126(21101624(171121)3620(4)5)25(28(33)29(31)34)27(32)22121423(151322)3583h1017202632H691819H215H3b2725+
MFCD18244131
ZINC000102515625
ZINC000102515635
Check stock
See real-time availability and sample size for STK562805 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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