Vitas-M small molecule compound
benzyl 4-(3-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK073598
SMILES CCOc1cc(ccc1O)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)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 C32H31NO5 MW 509.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31NO5/c1-3-37-28-18-23(14-15-26(28)34)30-29(32(36)38-19-21-10-6-4-7-11-21)20(2)33-25-16-24(17-27(35)31(25)30)22-12-8-5-9-13-22/h4-15,18,24,30,33-34H,3,16-17,19H2,1-2H3InChIKey
UOFXXVJASTWENW-UHFFFAOYSA-NSynonyms
5706-17-21HINDEN1ONE2((4CHLOROPHENYL)METHYLENE)23DIHYDRO
5706172
benzyl4(3ethoxy4hydroxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
benzyl4(3ethoxy4hydroxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OCC5=CC=CC=C5)C)O
CCOc1cc(ccc1O)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCc1ccccc1
InChI=1SC32H31NO5c1337281823(141526(28)34)3029(32(36)381921106471121)20(2)33251624(1727(35)31(25)30)22128591322h4151824303334H3161719H212H3
MFCD01528069
STK073598
ZINC000004068269
ZINC000004068272
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