Reaction Details | |
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Cell Reactant: | BDBM11 |
Syringe Reactant: | BDBM36165 |
Meas. Tech.: | ITC |
Entry Date: | 11/05/10 |
ΔG°: | -20.6±0.0500 (kJ/mole) |
pH: | 7.2±0 |
Log10Kb: | 3.61± 1.92 |
Temperature: | 298.15±0 (K) |
ΔH° : | -23.0±0.450 (kJ/mole) |
ΔHobs: | n/a |
Ionic Strength: | n/a |
n/a | |
Protons Released: | n/a |
ΔCp : | n/a |
Stoich. Param.: | n/a |
ΔS° : | -0.008± (kJ/mole-K) |
Comments: | First trial |
Citation | Liu, Y; Yang, YW; Cao, R; Song, SH; Zhang, HY; Wang, LH Thermodynamic Origin of Molecular Selective Binding of Bile Salts by Aminated β-Cyclodextrins J Phys Chem B107:14130 (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 |
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 | |
BDBM36165 | |
Source: | n/a |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM36165 |
Synonyms: | cholate (CA) |
Type | Guest |
Emp. Form. | C24H39O5 |
Mol. Mass. | 407.564 |
SMILES | CC(CCC([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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