Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(3-ethoxy-4-propoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Catalog ID
STK563215
SMILES CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[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 C32H42N2O6 MW 550.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H42N2O6/c1-6-17-39-26-14-11-22(20-27(26)38-9-4)29-28(30(35)23-12-13-25-24(19-23)18-21(5)40-25)31(36)32(37)34(29)16-10-15-33(7-2)8-3/h11-14,19-21,29,35H,6-10,15-18H2,1-5H3/b30-28+InChIKey
QCVTVDZJZPABSB-SJCQXOIGSA-NSynonyms
(4E)1(3(DIETHYLAMINO)PROPYL)5(3ETHOXY4PROPOXYPHENYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)2(3ethoxy4propoxyphenyl)45dioxopyrrolidin3ylidene)(2methyl23dihydro1benzofuran5yl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(3ETHOXY4PROPOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL23DIHYDRO1BENZOFURAN5YL)METHANOLATE
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)(O))C(=O)C(=O)N2CCC(NH+)(CC)CC)OCC
CCCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)CC(O3)C)(O))C(=O)C(=O)N1CCC(NH+)(CC)CC
InChI=1SC32H42N2O6c16173926141122(2027(26)3894)2928(30(35)2312132524(1923)1821(5)4025)31(36)32(37)34(29)16101533(72)83h111419212935H6101518H215H3b3028+
MFCD18244241
ZINC000102518720
ZINC000102646368
Check stock
See real-time availability and sample size for STK563215 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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