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Cell Reactant:BDBM11
Syringe Reactant:BDBM36170
Meas. Tech.:ITC
Entry Date:11/05/10
 
ΔG°:-4.59±0 (kcal/mole)
pH:7.2±0
Log10Kb:3.36± 1.11
Temperature:298.15±0 (K)
ΔH° :-5.69±0.0200 (kcal/mole)
ΔHobs:n/a
Ionic Strength:n/a
Corrected for ΔHioniz:n/a
Protons Released:n/a
ΔCp :n/a
Stoich. Param.:n/a
ΔS° :0± (kcal/mole-K)
Comments:First trial
 
Citation Liu YYang YWCao RSong SHZhang HYWang LH Thermodynamic Origin of Molecular Selective Binding of Bile Salts by Aminated β-Cyclodextrins J Phys Chem B 107:14130 (2003)    Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM11
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM11
Synonyms:beta-cyclodextrin | betadex
TypeMolecular 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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BDBM36170
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36170
Synonyms:taurocholate (TCA)
TypeGuest
Emp. Form.C26H44NO7S
Mol. Mass.514.696
SMILESCC(CCC(=O)NCCS([O-])(=O)=O)[C@H]1CCC2C3[C@@H](O)CC4C[C@H](O)CC[C@]4(C)C3C[C@H](O)[C@]12C
Structure
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