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Cell Reactant:BDBM36126
Syringe Reactant:BDBM36212
Meas. Tech.:ITC
Entry Date:12/08/10
 
ΔG°:-1.89±0.140 (kcal/mole)
pH:6.9±0
Log10Kb:1.38± 0.699
Temperature:298.15±0 (K)
ΔH° :-2.87±0.240 (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±0 (kcal/mole-K)
Comments:First trial
 
Citation Rekharsky, MVYamamura, HKawai, MInoue, Y Complexation and chiral recognition thermodynamics of gamma-cyclodextrin with N-acetyl- and N-carbobenzyloxy-dipeptides possessing two aromatic rings. J Org Chem68:5228-35 (2003) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM36126
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36126
Synonyms:gamma-cyclodextrin
TypeMolecular Host
Emp. Form.C48H80O40
Mol. Mass.1297.1248
SMILESOC[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]9[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]9O)[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
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BDBM36212
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36212
Synonyms:Ac-D-Phe-D-Tyr
TypeGuest
Emp. Form.C20H22N2O5
Mol. Mass.370.3991
SMILESCC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccc(O)cc1)C(O)=O
Structure
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