Vitas-M small molecule compound
benzyl 4-[2-(benzyloxy)phenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372462
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CC(C2)c1ccccc1)OCc1ccccc1
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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 C37H33NO4 MW 555.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H33NO4/c1-25-34(37(40)42-24-27-15-7-3-8-16-27)35(30-19-11-12-20-33(30)41-23-26-13-5-2-6-14-26)36-31(38-25)21-29(22-32(36)39)28-17-9-4-10-18-28/h2-20,29,35,38H,21-24H2,1H3InChIKey
HXJPTLJZIVUXNL-UHFFFAOYSA-NSynonyms
benzyl2methyl5oxo7phenyl4(2phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
benzyl4(2(benzyloxy)phenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4OCC5=CC=CC=C5)C(=O)OCC6=CC=CC=C6
InChI=1SC37H33NO4c12534(37(40)422427157381627)35(301911122033(30)412326135261426)3631(3825)2129(2232(36)39)281794101828h220293538H2124H21H3
MFCD00771597
ZINC000002057986
ZINC000002057989
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