Vitas-M small molecule compound
benzyl 4-(3-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK093550
SMILES COc1cccc(c1)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 C31H29NO4 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO4/c1-20-28(31(34)36-19-21-10-5-3-6-11-21)29(23-14-9-15-25(16-23)35-2)30-26(32-20)17-24(18-27(30)33)22-12-7-4-8-13-22/h3-16,24,29,32H,17-19H2,1-2H3InChIKey
MJOXXALMDIVQFV-UHFFFAOYSA-NSynonyms
benzyl4(3methoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
benzyl4(3methoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=CC=C4)OC)C(=O)OCC5=CC=CC=C5
COc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OCc1ccccc1
InChI=1SC31H29NO4c12028(31(34)361921105361121)29(231491525(1623)352)3026(3220)1724(1827(30)33)22127481322h316242932H1719H212H3
MFCD01529761
STK093550
ZINC000001201226
ZINC000001201234
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