Vitas-M small molecule compound
(E)-{2-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanolate
Catalog ID
STL148043
SMILES C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1
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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 C32H38N2O7 MW 562.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H38N2O7/c1-4-15-40-26-10-7-22(20-27(26)39-5-2)29-28(30(35)23-8-9-25-24(19-23)18-21(3)41-25)31(36)32(37)34(29)12-6-11-33-13-16-38-17-14-33/h4,7-10,19-21,29,35H,1,5-6,11-18H2,2-3H3/b30-28+InChIKey
FBVPATMHDCDPFX-SJCQXOIGSA-NSynonyms
(4E)5(3ETHOXY4PROP2ENOXYPHENYL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(3ethoxy4(prop2en1yloxy)phenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(2methyl23dihydro1benzofuran5yl)methanolate
(E)(2(3ETHOXY4PROP2ENOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL23DIHYDRO1BENZOFURAN5YL)METHANOLATE
C=CCOc1ccc(cc1OCC)C1C(=C(c2ccc3c(c2)CC(O3)C)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)(O))C(=O)C(=O)N2CCC(NH+)5CCOCC5)OCC=C
InChI=1SC32H38N2O7c1415402610722(2027(26)3952)2928(30(35)23892524(1923)1821(3)4125)31(36)32(37)34(29)1261133131638171433h471019212935H1561118H223H3b3028+
MFCD20755315
ZINC000101310325
ZINC000101310332
Check stock
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