Vitas-M small molecule compound

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

Catalog ID
STL435218
SMILES CCOC(=O)c1c[nH]c(=O)c(c1O)C(c1cc(OC)c(c(c1)OC)OC)CC(=O)NCCc1ccc(cc1)OC

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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 C29H34N2O9 MW 554.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N2O9/c1-6-40-29(35)21-16-31-28(34)25(26(21)33)20(18-13-22(37-3)27(39-5)23(14-18)38-4)15-24(32)30-12-11-17-7-9-19(36-2)10-8-17/h7-10,13-14,16,20H,6,11-12,15H2,1-5H3,(H,30,32)(H2,31,33,34)
InChIKey
KNVLIEKFYPOYLV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)NCCC2=CC=C(C=C2)OC)C3=CC(=C(C(=C3)OC)OC)OC
CCOC(=O)c1c(nH)c(=O)c(c1O)C(c1cc(OC)c(c(c1)OC)OC)CC(=O)NCCc1ccc(cc1)OC
ethyl4hydroxy5(3((2(4methoxyphenyl)ethyl)amino)3oxo1(345trimethoxyphenyl)propyl)6oxo16dihydropyridine3carboxylate
ethyl4hydroxy5(3(2(4methoxyphenyl)ethylamino)3oxo1(345trimethoxyphenyl)propyl)6oxo1Hpyridine3carboxylate
InChI=1SC29H34N2O9c164029(35)21163128(34)25(26(21)33)20(181322(373)27(395)23(1418)384)1524(32)301211177919(362)10817h71013141620H6111215H215H3(H3032)(H2313334)
MFCD30711754
ZINC000253496524
ZINC000253496525

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Available files

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