Vitas-M small molecule compound
ethyl 5-[1-(1,3-benzodioxol-5-yl)-3-{[2-(4-hydroxyphenyl)ethyl]amino}-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435204
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1ccc(cc1)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 C26H26N2O8 MW 494.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O8/c1-2-34-26(33)19-13-28-25(32)23(24(19)31)18(16-5-8-20-21(11-16)36-14-35-20)12-22(30)27-10-9-15-3-6-17(29)7-4-15/h3-8,11,13,18,29H,2,9-10,12,14H2,1H3,(H,27,30)(H2,28,31,32)InChIKey
IEYUJGSNLBQWIC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)NCCC2=CC=C(C=C2)O)C3=CC4=C(C=C3)OCO4
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1ccc(cc1)O
ethyl5(1(13benzodioxol5yl)3((2(4hydroxyphenyl)ethyl)amino)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(1(13benzodioxol5yl)3(2(4hydroxyphenyl)ethylamino)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC26H26N2O8c123426(33)19132825(32)23(24(19)31)18(16582021(1116)36143520)1222(30)27109153617(29)7415h3811131829H29101214H21H3(H2730)(H2283132)
MFCD30711740
ZINC000253496498
ZINC000253496499
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