Vitas-M small molecule compound
cyclopentyl 4-(4-ethoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372452
SMILES CCOc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC1CCCC1
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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 C30H33NO4 MW 471.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO4/c1-3-34-23-15-13-21(14-16-23)28-27(30(33)35-24-11-7-8-12-24)19(2)31-25-17-22(18-26(32)29(25)28)20-9-5-4-6-10-20/h4-6,9-10,13-16,22,24,28,31H,3,7-8,11-12,17-18H2,1-2H3InChIKey
BOLKPGNUAUBCNB-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OC5CCCC5)C
cyclopentyl4(4ethoxyphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
cyclopentyl4(4ethoxyphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC30H33NO4c133423151321(141623)2827(30(33)352411781224)19(2)31251722(1826(32)29(25)28)2095461020h46910131622242831H37811121718H212H3
MFCD00771509
ZINC000004065524
ZINC000004065535
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