Vitas-M small molecule compound
benzyl 4-(2,3-dimethoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372510
SMILES COc1cccc(c1OC)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCc1ccccc1
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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/c1-16-22(26(29)32-15-17-9-5-4-6-10-17)23(24-19(27-16)12-8-13-20(24)28)18-11-7-14-21(30-2)25(18)31-3/h4-7,9-11,14,23,27H,8,12-13,15H2,1-3H3InChIKey
JWPMNJFFUMUNRY-UHFFFAOYSA-NSynonyms
299945-98-5299945985
benzyl4(23dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(23dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)OC)OC)C(=O)OCC4=CC=CC=C4
InChI=1SC26H27NO5c11622(26(29)32151795461017)23(2419(2716)1281320(24)28)181171421(302)25(18)313h47911142327H8121315H213H3
MFCD00752953
ZINC000019535462
ZINC000019535465
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