Vitas-M small molecule compound
ethyl 5-[1-(1,3-benzodioxol-5-yl)-3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435205
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1ccc(c(c1)OCC)OCC
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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 C30H34N2O9 MW 566.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O9/c1-4-37-22-9-7-18(13-24(22)38-5-2)11-12-31-26(33)15-20(19-8-10-23-25(14-19)41-17-40-23)27-28(34)21(16-32-29(27)35)30(36)39-6-3/h7-10,13-14,16,20H,4-6,11-12,15,17H2,1-3H3,(H,31,33)(H2,32,34,35)InChIKey
QQVUUGIDKPVWHQ-UHFFFAOYSA-NSynonyms
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1ccc2c(c1)OCO2)CC(=O)NCCc1ccc(c(c1)OCC)OCC
CCOC1=C(C=C(C=C1)CCNC(=O)CC(C2=CC3=C(C=C2)OCO3)C4=C(C(=CNC4=O)C(=O)OCC)O)OCC
ethyl5(1(13benzodioxol5yl)3((2(34diethoxyphenyl)ethyl)amino)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(1(13benzodioxol5yl)3(2(34diethoxyphenyl)ethylamino)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC30H34N2O9c1437229718(1324(22)3852)11123126(33)1520(198102325(1419)41174023)2728(34)21(163229(27)35)30(36)3963h71013141620H4611121517H213H3(H3133)(H2323435)
MFCD30711741
ZINC000253496575
ZINC000253496576
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