Vitas-M small molecule compound
benzyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372436
SMILES COc1ccc(c(c1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1)OC
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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 C26H27NO5 MW 433.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO5/c1-16-23(26(29)32-15-17-8-5-4-6-9-17)24(25-20(27-16)10-7-11-21(25)28)19-14-18(30-2)12-13-22(19)31-3/h4-6,8-9,12-14,24,27H,7,10-11,15H2,1-3H3InChIKey
SSXCLMWWITYXMJ-UHFFFAOYSA-NSynonyms
benzyl4(25dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(25dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=CC(=C3)OC)OC)C(=O)OCC4=CC=CC=C4
InChI=1SC26H27NO5c11623(26(29)3215178546917)24(2520(2716)1071121(25)28)191418(302)121322(19)313h468912142427H7101115H213H3
MFCD00771216
ZINC000019855094
ZINC000019855097
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