Vitas-M small molecule compound

ethyl 5-[3-{[2-(3,4-diethoxyphenyl)ethyl]amino}-1-(3-hydroxy-4-methoxyphenyl)-3-oxopropyl]-4-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxylate

Catalog ID
STL435199
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1ccc(c(c1)O)OC)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 C30H36N2O9 MW 568.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N2O9/c1-5-39-24-10-8-18(14-25(24)40-6-2)12-13-31-26(34)16-20(19-9-11-23(38-4)22(33)15-19)27-28(35)21(17-32-29(27)36)30(37)41-7-3/h8-11,14-15,17,20,33H,5-7,12-13,16H2,1-4H3,(H,31,34)(H2,32,35,36)
InChIKey
CUIIEIYKTJCRKM-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1ccc(c(c1)O)OC)CC(=O)NCCc1ccc(c(c1)OCC)OCC
CCOC1=C(C=C(C=C1)CCNC(=O)CC(C2=CC(=C(C=C2)OC)O)C3=C(C(=CNC3=O)C(=O)OCC)O)OCC
ethyl5(3((2(34diethoxyphenyl)ethyl)amino)1(3hydroxy4methoxyphenyl)3oxopropyl)4hydroxy6oxo16dihydropyridine3carboxylate
ethyl5(3(2(34diethoxyphenyl)ethylamino)1(3hydroxy4methoxyphenyl)3oxopropyl)4hydroxy6oxo1Hpyridine3carboxylate
InChI=1SC30H36N2O9c15392410818(1425(24)4062)12133126(34)1620(1991123(384)22(33)1519)2728(35)21(173229(27)36)30(37)4173h8111415172033H57121316H214H3(H3134)(H2323536)
MFCD30711735
ZINC000253496460
ZINC000253496461

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.