Vitas-M small molecule compound
3-butan-2-yl 6-methyl 4-(4-methoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405038
SMILES CCC(OC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC)C(=O)C(C(C2)C)C(=O)OC)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 C25H31NO6 MW 441.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO6/c1-7-14(3)32-25(29)20-15(4)26-18-12-13(2)19(24(28)31-6)23(27)22(18)21(20)16-8-10-17(30-5)11-9-16/h8-11,13-14,19,21,26H,7,12H2,1-6H3InChIKey
BPOSQZXVLJVTMY-UHFFFAOYSA-NSynonyms
3butan2yl6methyl4(4methoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Obutan2yl6Omethyl4(4methoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)OC)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC25H31NO6c1714(3)3225(29)2015(4)26181213(2)19(24(28)316)23(27)22(18)21(20)1681017(305)11916h8111314192126H712H216H3
MFCD06194105
ZINC000001461142
ZINC000229942045
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