Vitas-M small molecule compound
3-butan-2-yl 6-methyl 4-(2-butoxyphenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405008
SMILES CCCCOc1ccccc1C1C(=C(C)NC2=C1C(=O)C(C(C2)C)C(=O)OC)C(=O)OC(CC)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 C28H37NO6 MW 483.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37NO6/c1-7-9-14-34-21-13-11-10-12-19(21)24-23(28(32)35-17(4)8-2)18(5)29-20-15-16(3)22(27(31)33-6)26(30)25(20)24/h10-13,16-17,22,24,29H,7-9,14-15H2,1-6H3InChIKey
VVGKVIVMULHCIP-UHFFFAOYSA-NSynonyms
3butan2yl6methyl4(2butoxyphenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Obutan2yl6Omethyl4(2butoxyphenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCCCOC1=CC=CC=C1C2C3=C(CC(C(C3=O)C(=O)OC)C)NC(=C2C(=O)OC(C)CC)C
InChI=1SC28H37NO6c1791434211311101219(21)2423(28(32)3517(4)82)18(5)29201516(3)22(27(31)336)26(30)25(20)24h10131617222429H791415H216H3
MFCD06194082
ZINC000012319958
ZINC000229938447
Check stock
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Check stock on Vitas-MAvailable files
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