Vitas-M small molecule compound
diprop-2-en-1-yl 2-(4-fluorophenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STK728590
SMILES C=CCOC(=O)C1C(=O)CC(C(C1c1ccc(cc1)F)C(=O)OCC=C)(C)O
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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 C21H23FO6 MW 390.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23FO6/c1-4-10-27-19(24)17-15(23)12-21(3,26)18(20(25)28-11-5-2)16(17)13-6-8-14(22)9-7-13/h4-9,16-18,26H,1-2,10-12H2,3H3InChIKey
RNKCJFOKJLSLEY-UHFFFAOYSA-NSynonyms
BIS(PROP2ENYL)2(4FLUOROPHENYL)4HYDROXY4METHYL6OXOCYCLOHEXANE13DICARBOXYLATE
CC1(CC(=O)C(C(C1C(=O)OCC=C)C2=CC=C(C=C2)F)C(=O)OCC=C)O
diprop2en1yl2(4fluorophenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
InChI=1SC21H23FO6c14102719(24)1715(23)1221(326)18(20(25)281152)16(17)136814(22)9713h49161826H121012H23H3
MFCD03883627
ZINC000004127504
ZINC000239403141
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