Vitas-M small molecule compound
methyl 4-[4-(acetyloxy)-3-ethoxyphenyl]-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK406066
SMILES CCOc1cc(ccc1OC(=O)C)C1C(=C(C)NC2=C1C(=O)CC(C2)c1ccco1)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 C26H27NO7 MW 465.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO7/c1-5-32-22-13-16(8-9-21(22)34-15(3)28)24-23(26(30)31-4)14(2)27-18-11-17(12-19(29)25(18)24)20-7-6-10-33-20/h6-10,13,17,24,27H,5,11-12H2,1-4H3InChIKey
JNOIEHKEUITTCR-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CO4)NC(=C2C(=O)OC)C)OC(=O)C
InChI=1SC26H27NO7c1532221316(8921(22)3415(3)28)2423(26(30)314)14(2)27181117(1219(29)25(18)24)2076103320h61013172427H51112H214H3
methyl4(4(acetyloxy)3ethoxyphenyl)7(furan2yl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4acetyloxy3ethoxyphenyl)7(furan2yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD04216282
ZINC000016293998
ZINC000016294003
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