Vitas-M small molecule compound
cyclohexyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402456
SMILES Fc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)OC1CCCCC1
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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 C29H30FNO3 MW 459.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30FNO3/c1-18-26(29(33)34-23-13-6-3-7-14-23)27(20-11-8-12-22(30)15-20)28-24(31-18)16-21(17-25(28)32)19-9-4-2-5-10-19/h2,4-5,8-12,15,21,23,27,31H,3,6-7,13-14,16-17H2,1H3InChIKey
AKISHPAFWCATEC-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=CC=C4)F)C(=O)OC5CCCCC5
cyclohexyl4(3fluorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
cyclohexyl4(3fluorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
InChI=1SC29H30FNO3c11826(29(33)3423136371423)27(201181222(30)1520)2824(3118)1621(1725(28)32)1994251019h2458121521232731H36713141617H21H3
MFCD01445728
ZINC000002775391
ZINC000002775394
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