Vitas-M small molecule compound
methyl 4-[4-(methoxycarbonyl)phenyl]-7-methyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate
Catalog ID
STK406967
SMILES COC(=O)c1ccc(cc1)C1CC(=O)NC2=C1C(=O)C(C(C2)C)C(=O)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 C20H21NO6 MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6/c1-10-8-14-17(18(23)16(10)20(25)27-3)13(9-15(22)21-14)11-4-6-12(7-5-11)19(24)26-2/h4-7,10,13,16H,8-9H2,1-3H3,(H,21,22)InChIKey
SYHBDYUFZKQKFW-UHFFFAOYSA-NSynonyms
CC1CC2=C(C(CC(=O)N2)C3=CC=C(C=C3)C(=O)OC)C(=O)C1C(=O)OC
InChI=1SC20H21NO6c11081417(18(23)16(10)20(25)273)13(915(22)2114)114612(7511)19(24)262h47101316H89H213H3(H2122)
methyl4(4(methoxycarbonyl)phenyl)7methyl25dioxo12345678octahydroquinoline6carboxylate
methyl4(4methoxycarbonylphenyl)7methyl25dioxo134678hexahydroquinoline6carboxylate
MFCD07613434
ZINC000006820002
ZINC000169680842
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