Vitas-M small molecule compound
cyclohexyl 4-[4-(benzyloxy)phenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK364268
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(cc1)OCc1ccccc1)C(=O)CC(C2)c1ccccc1)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 C36H37NO4 MW 547.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H37NO4/c1-24-33(36(39)41-30-15-9-4-10-16-30)34(27-17-19-29(20-18-27)40-23-25-11-5-2-6-12-25)35-31(37-24)21-28(22-32(35)38)26-13-7-3-8-14-26/h2-3,5-8,11-14,17-20,28,30,34,37H,4,9-10,15-16,21-23H2,1H3InChIKey
XWFMKKNCADROJA-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)OC6CCCCC6
cyclohexyl2methyl5oxo7phenyl4(4phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
cyclohexyl4(4(benzyloxy)phenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
InChI=1SC36H37NO4c12433(36(39)41301594101630)34(27171929(201827)402325115261225)3531(3724)2128(2232(35)38)26137381426h23581114172028303437H491015162123H21H3
MFCD01136957
ZINC000002059499
ZINC000002059502
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