Cell Reactant:
BDBM11
Syringe Reactant:
BDBM36121
Meas. Tech.:
ITC
Entry Date.:
10/15/10
ΔG°:
-11.78±0.07 (kJ/mole)
pH:
6.9±0
Log10Kb:
0.5
Temperature:
298.15±0 (K)
ΔH° :
-14.8±0.2 (kJ/mole)
ΔS° :
-0.01±0.0007 (kJ/mole-K)
Comments:
First trial
Citation
 Yamamura, HRekharsky, MVIshihara, YKawai, MInoue, Y Factors controlling the complex architecture of native and modified cyclodextrins with dipeptide (Z-Glu-Tyr) studied by microcalorimetry and NMR spectroscopy: critical effects of peripheral bis-trimethylamination and cavity size. J Am Chem Soc 126:14224-33 (2004) [PubMed]  Article
Cell React
Source:
7585-39-9
Name:
BDBM11
Synonyms:
beta-cyclodextrin | betadex
Type:
Molecular Host
Emp. Form.:
C42H70O35
Mol. Mass.:
1134.9842
SMILES:
[H][C@]1(CO)O[C@]2([H])O[C@]3([H])[C@@]([H])(CO)O[C@]([H])(O[C@]4([H])[C@@]([H])(CO)O[C@]([H])(O[C@]5([H])[C@@]([H])(CO)O[C@]([H])(O[C@]6([H])[C@@]([H])(CO)O[C@]([H])(O[C@]7([H])[C@@]([H])(CO)O[C@]([H])(O[C@]8([H])[C@@]([H])(CO)O[C@]([H])(O[C@@]1([H])[C@]([H])(O)[C@@]2([H])O)[C@]([H])(O)[C@@]8([H])O)[C@]([H])(O)[C@@]7([H])O)[C@]([H])(O)[C@@]6([H])O)[C@]([H])(O)[C@@]5([H])O)[C@]([H])(O)[C@@]4([H])O)[C@]([H])(O)[C@@]3([H])O
Structure:
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Syringe React
Name:
BDBM36121
Synonyms:
Z-D-Glu-L-Tyr
Type:
Guest
Emp. Form.:
C22H24N2O8
Mol. Mass.:
444.4346
SMILES:
OC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Structure:
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