2 article(s) from Legnani, Laura
Oxidation of alkanes with RuO4.
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Mechanisms for RuO4 oxidation of alkanes.
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Oxidation of saturated five-membered (hetero)cyclic compounds.
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Rate-limiting step for the oxidation of cyclopentane (R1), tetrahydrofuran (R2) and tetrahydrothiop...
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Optimized (B3LYP-d3bj/Def2SVP/cpcm=MeCN) geometries of transition structures corresponding to the o...
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ELF analysis for the oxidation of cyclopentane (R1). Left: evolution of the electron population alo...
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ELF analysis for the oxidation of tetrahydrofuran (R2, A) and tetrahydrothiophene (R3, B). Left: ev...
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ELF assignment of electrons to the Ru environment. C(Ru) corresponds to a monosynaptic core basin a...
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Rate-limiting step for the oxidation of N-methyl- and N-benzylpyrrolidines R4 and R5, respectively.
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Energy profile for the oxidation of R4 and R5. Relative energies, calculated at the B3LYP-d3bj/Def2...
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Optimized (B3LYP-d3bj/Def2SVP/cpcm=water) transition structures for the oxidation of R4 and R5.
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Beilstein J. Org. Chem. 2019, 15, 1552–1562, doi:10.3762/bjoc.15.158
Some relevant MDM2-p53 interaction inhibitors.
Retrosynthetic route to spiro[isoindole-1,5-isoxazolidin]-3(2H)-ones 3.
Synthesis of compounds 2.
Synthesis of 6a–f by 1,3-dipolar cycloaddition.
Selected NOESY observed for compounds 6a and 7a.
ORTEP drawing of the X-ray crystal structure of 7a showing the model atomic numbering scheme (C10 a...
Three-dimensional plots of TSs of reaction of dipolarophiles (Z)-8 and (E)-8 with nitrone 4. The la...
Free energy profiles for the cycloaddition reaction of the two isomers Z (A) or E (B) of dipolaroph...
Compound 6e reduces cancer cell proliferation. Treatment of SH-SY5Y, HT-29 and HepG2 cells with 6e ...
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Cytotoxic effect of 6e. The cytotoxic activity of 6e was assessed in terms of both LDH release (a) ...
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6e modulate the levels of p53 in SH-SY5Y cells. (a) The SH-SY5Y cells were treated for 24 h with th...
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(A) Representative Western Blots and (B) semiquantitative analyses of p53, MDM2, p21 expression lev...
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(A) Representative Western Blots and (B) densitometric analysis of caspase-3 and PARP cleavage in t...
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Compounds 6a (green) and 6c (blue) docked into MDM2 structure (PDB-ID: 3LBL) superimposed on the ke...
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A) Compounds 6e (green) docked into MDM2 structure (PDB-ID: 3LBL); His96 and p53 residue (yellow st...
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Beilstein J. Org. Chem. 2016, 12, 2793–2807, doi:10.3762/bjoc.12.278
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