Vitas-M small molecule compound
6-methyl 3-propan-2-yl 4-(2-butoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404834
SMILES CCCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OC(C)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 C27H35NO6 MW 469.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO6/c1-7-8-13-33-20-12-10-9-11-18(20)23-22(27(31)34-15(2)3)17(5)28-19-14-16(4)21(26(30)32-6)25(29)24(19)23/h9-12,15-16,21,23,28H,7-8,13-14H2,1-6H3InChIKey
RVQLZXLEQJXUMT-UHFFFAOYSA-NSynonyms
6methyl3propan2yl4(2butoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
6Omethyl3Opropan2yl4(2butoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCCOC1=CC=CC=C1C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OC(C)C)C
InChI=1SC27H35NO6c178133320121091118(20)2322(27(31)3415(2)3)17(5)28191416(4)21(26(30)326)25(29)24(19)23h9121516212328H781314H216H3
MFCD05996212
ZINC000004762050
ZINC000101922371
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Check stock on Vitas-MAvailable files
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