Vitas-M small molecule compound
cyclohexyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(3-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK020061
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=C(C2c1cccc(c1)C)C(=O)OC1CCCCC1)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 C32H37NO5 MW 515.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37NO5/c1-19-9-8-10-22(15-19)30-29(32(35)38-24-11-6-5-7-12-24)20(2)33-25-16-23(17-26(34)31(25)30)21-13-14-27(36-3)28(18-21)37-4/h8-10,13-15,18,23-24,30,33H,5-7,11-12,16-17H2,1-4H3InChIKey
HPLHMIOACZLFIC-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC(=C2C(=O)OC5CCCCC5)C
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=C(C2c1cccc(c1)C)C(=O)OC1CCCCC1)C
cyclohexyl7(34dimethoxyphenyl)2methyl4(3methylphenyl)5oxo145678hexahydroquinoline3carboxylate
cyclohexyl7(34dimethoxyphenyl)2methyl4(3methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC32H37NO5c119981022(1519)3029(32(35)3824116571224)20(2)33251623(1726(34)31(25)30)21131427(363)28(1821)374h81013151823243033H5711121617H214H3
MFCD02224271
STK020061
ZINC000006442934
ZINC000006442990
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