Vitas-M small molecule compound
bis(2-methylpropyl) 2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STL537092
SMILES COc1ccc(cc1OC)C1C(C(=O)OCC(C)C)C(=O)CC(C1C(=O)OCC(C)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 C25H36O8 MW 464.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36O8/c1-14(2)12-32-23(27)21-17(26)11-25(5,29)22(24(28)33-13-15(3)4)20(21)16-8-9-18(30-6)19(10-16)31-7/h8-10,14-15,20-22,29H,11-13H2,1-7H3InChIKey
NCTYGLPITBDCSR-UHFFFAOYSA-NSynonyms
1005106-12-61005106126
3748625
bis(2methylpropyl)2(34dimethoxyphenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
diisobutyl2(34dimethoxyphenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
InChI=1SC25H36O8c114(2)123223(27)2117(26)1125(529)22(24(28)331315(3)4)20(21)168918(306)19(1016)317h8101415202229H1113H217H3
MFCD03267252
ZINC000009033249
ZINC000248163873
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