Vitas-M small molecule compound
cyclohexyl 4-(4-ethylphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK363268
SMILES CCc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)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 C25H31NO3 MW 393.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO3/c1-3-17-12-14-18(15-13-17)23-22(25(28)29-19-8-5-4-6-9-19)16(2)26-20-10-7-11-21(27)24(20)23/h12-15,19,23,26H,3-11H2,1-2H3InChIKey
WADXECQUQHAXAC-UHFFFAOYSA-NSynonyms
299946-45-5299946455
CCC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OC4CCCCC4)C
cyclohexyl4(4ethylphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(4ethylphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC25H31NO3c1317121418(151317)2322(25(28)29198546919)16(2)26201071121(27)24(20)23h1215192326H311H212H3
MFCD00753027
ZINC000004066021
ZINC000004066023
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