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| Reaction Details | |
|---|---|
 | Report a problem with these data |
| Cell Reactant: | BDBM36127 |
| Syringe Reactant: | BDBM36170 |
| Meas. Tech.: | ITC |
| Entry Date: | 11/05/10 |
| ΔG°: | -4.59±0.0200 (kcal/mole) |
| pH: | 7.2±0 |
| Log10Kb: | 3.36± 1.91 |
| Temperature: | 298.15±0 (K) |
| ΔH° : | -6.43±0.0200 (kcal/mole) |
| ΔHobs: | n/a |
| Ionic Strength: | n/a |
| n/a | |
| Protons Released: | n/a |
| ΔCp : | n/a |
| Stoich. Param.: | n/a |
| ΔS° : | -0.0100± (kcal/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 |
| BDBM36127 | |
| Source: | n/a |
| Purity: | n/a |
| Prep. Method: | n/a |
| Name | BDBM36127 |
| Synonyms: | 6-Amino-6-deoxy-beta-cyclodextrin (am-beta-CD) | 6-NH2-beta-cyclodextrin | mono(6-amino-6-deoxy)-beta-cyclodextrin |
| Type | Molecular Host |
| Emp. Form. | C42H72NO34 |
| Mol. Mass. | 1135.0068 |
| SMILES | [NH3+]C[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O |
| Structure | 
|
| BDBM36170 | |
| Source: | n/a |
| Purity: | n/a |
| Prep. Method: | n/a |
| Name | BDBM36170 |
| Synonyms: | taurocholate (TCA) |
| Type | Guest |
| Emp. Form. | C26H44NO7S |
| Mol. Mass. | 514.696 |
| SMILES | CC(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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