Vitas-M small molecule compound
2-phenoxyethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK095870
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(c(c1)OC)OCc1ccccc1)C(=O)OCCOc1ccccc1)C
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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 C40H39NO7 MW 645.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H39NO7/c1-26-37(40(43)47-21-20-46-32-12-8-5-9-13-32)38(29-16-19-35(36(24-29)45-3)48-25-27-10-6-4-7-11-27)39-33(41-26)22-30(23-34(39)42)28-14-17-31(44-2)18-15-28/h4-19,24,30,38,41H,20-23,25H2,1-3H3InChIKey
FWZRDDQXKMGYIS-UHFFFAOYSA-NSynonyms
312586-37-12phenoxyethyl4(4(benzyloxy)3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
2phenoxyethyl7(4methoxyphenyl)4(3methoxy4phenylmethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
312586371
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OC)C(=O)OCCOC6=CC=CC=C6
COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(c(c1)OC)OCc1ccccc1)C(=O)OCCOc1ccccc1)C
InChI=1SC40H39NO7c12637(40(43)4721204632128591332)38(29161935(36(2429)453)482527106471127)3933(4126)2230(2334(39)42)28141731(442)181528h41924303841H202325H213H3
MFCD01823651
STK095870
ZINC000150425153
ZINC000150425163
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