Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(3-methoxy-4-propoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STK562431
SMILES CCCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)OCC)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)CC
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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 C30H40N2O6 MW 524.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H40N2O6/c1-6-19-38-24-16-13-22(20-25(24)36-5)27-26(28(33)21-11-14-23(15-12-21)37-9-4)29(34)30(35)32(27)18-10-17-31(7-2)8-3/h11-16,20,27,33H,6-10,17-19H2,1-5H3/b28-26+InChIKey
IYMYGFNIMJQROD-BYCLXTJYSA-NSynonyms
636989-39-4(4E)1(3(DIETHYLAMINO)PROPYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(3METHOXY4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)2(3methoxy4propoxyphenyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(3METHOXY4PROPOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(3METHOXY4PROPOXYPHENYL)3PYRROLIN2ONE
636989394
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC)O)C(=O)C(=O)N2CCCN(CC)CC)OC
CCCOc1ccc(cc1OC)C1C(=C(c2ccc(cc2)OCC)(O))C(=O)C(=O)N1CCC(NH+)(CC)CC
InChI=1SC30H40N2O6c16193824161322(2025(24)365)2726(28(33)21111423(151221)3794)29(34)30(35)32(27)18101731(72)83h1116202733H6101719H215H3b2826+
MFCD18244046
ZINC000009046584
ZINC000009046585
Check stock
See real-time availability and sample size for STK562431 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.