Vitas-M small molecule compound
cyclohexyl 2,7,7-trimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372325
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1)C(=O)CC(C2)(C)C)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 C25H31NO3 MW 393.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO3/c1-16-21(24(28)29-18-12-8-5-9-13-18)22(17-10-6-4-7-11-17)23-19(26-16)14-25(2,3)15-20(23)27/h4,6-7,10-11,18,22,26H,5,8-9,12-15H2,1-3H3InChIKey
ONIZFNUXCGRDPT-UHFFFAOYSA-NSynonyms
299451-00-6299451006
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CC=C3)C(=O)OC4CCCCC4
cyclohexyl277trimethyl5oxo4phenyl145678hexahydroquinoline3carboxylate
cyclohexyl277trimethyl5oxo4phenyl1468tetrahydroquinoline3carboxylate
InChI=1SC25H31NO3c11621(24(28)2918128591318)22(17106471117)2319(2616)1425(23)1520(23)27h4671011182226H5891215H213H3
MFCD00770990
ZINC000019798121
ZINC000019798123
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