Vitas-M small molecule compound
ethyl 5-[3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-1-(7-methoxy-1,3-benzodioxol-5-yl)-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate
Catalog ID
STL435210
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1cc(OC)c2c(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 C31H36N2O10 MW 596.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2O10/c1-5-39-22-9-8-18(12-23(22)40-6-2)10-11-32-26(34)15-20(19-13-24(38-4)29-25(14-19)42-17-43-29)27-28(35)21(16-33-30(27)36)31(37)41-7-3/h8-9,12-14,16,20H,5-7,10-11,15,17H2,1-4H3,(H,32,34)(H2,33,35,36)InChIKey
KMGWTBIDZHUWEM-UHFFFAOYSA-NSynonyms
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1cc(OC)c2c(c1)OCO2)CC(=O)NCCc1ccc(c(c1)OCC)OCC
CCOC1=C(C=C(C=C1)CCNC(=O)CC(C2=CC3=C(C(=C2)OC)OCO3)C4=C(C(=CNC4=O)C(=O)OCC)O)OCC
ethyl5(3((2(34diethoxyphenyl)ethyl)amino)1(7methoxy13benzodioxol5yl)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(3(2(34diethoxyphenyl)ethylamino)1(7methoxy13benzodioxol5yl)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC31H36N2O10c1539229818(1223(22)4062)10113226(34)1520(191324(384)2925(1419)42174329)2728(35)21(163330(27)36)31(37)4173h8912141620H5710111517H214H3(H3234)(H2333536)
MFCD30711746
ZINC000253496522
ZINC000253496523
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.