Vitas-M small molecule compound
6-methyl 3-propyl 4-(3-ethoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404481
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1cccc(c1)OCC)C(=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 C25H31NO6 MW 441.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO6/c1-6-11-32-25(29)20-15(4)26-18-12-14(3)19(24(28)30-5)23(27)22(18)21(20)16-9-8-10-17(13-16)31-7-2/h8-10,13-14,19,21,26H,6-7,11-12H2,1-5H3InChIKey
XQJVZSCLIRUUCJ-UHFFFAOYSA-NSynonyms
6methyl3propyl4(3ethoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropyl4(3ethoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)OCC)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC25H31NO6c16113225(29)2015(4)26181214(3)19(24(28)305)23(27)22(18)21(20)16981017(1316)3172h8101314192126H671112H215H3
MFCD04226241
ZINC000019634128
ZINC000033936441
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