Vitas-M small molecule compound
benzyl 4-[4-(acetyloxy)-3-methoxyphenyl]-7-(4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK062797
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(c(c1)OC)OC(=O)C)C(=O)OCc1ccccc1)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 C34H33NO7 MW 567.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33NO7/c1-20-31(34(38)41-19-22-8-6-5-7-9-22)32(24-12-15-29(42-21(2)36)30(18-24)40-4)33-27(35-20)16-25(17-28(33)37)23-10-13-26(39-3)14-11-23/h5-15,18,25,32,35H,16-17,19H2,1-4H3InChIKey
BSUISPGUVCRMIN-UHFFFAOYSA-NSynonyms
benzyl4(4(acetyloxy)3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(4acetyloxy3methoxyphenyl)7(4methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OC)C4=CC(=C(C=C4)OC(=O)C)OC)C(=O)OCC5=CC=CC=C5
COc1ccc(cc1)C1CC(=O)C2=C(C1)NC(=C(C2c1ccc(c(c1)OC)OC(=O)C)C(=O)OCc1ccccc1)C
InChI=1SC34H33NO7c12031(34(38)4119228657922)32(24121529(4221(2)36)30(1824)404)3327(3520)1625(1728(33)37)23101326(393)141123h51518253235H161719H214H3
MFCD01529837
STK062797
ZINC000001082086
ZINC000001082089
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Check stock on Vitas-MAvailable files
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