Cell Reactant:
BDBM36126
Syringe Reactant:
BDBM36235
Meas. Tech.:
ITC
Entry Date.:
12/08/10
ΔG°:
-10.18±0.06 (kJ/mole)
pH:
6.9±0
Log10Kb:
0.2
Temperature:
298.15±0 (K)
ΔH° :
-20.1±0.2 (kJ/mole)
ΔS° :
-0.0332±0.0007 (kJ/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 Chem 68:5228-35 (2003) [PubMed]  Article
Cell React
Name:
BDBM36126
Synonyms:
gamma-cyclodextrin
Type:
Molecular Host
Emp. Form.:
C48H80O40
Mol. Mass.:
1297.1248
SMILES:
OC[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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Syringe React
Name:
BDBM36235
Synonyms:
Cbz-L-Ala-L-Tyr
Type:
Guest
Emp. Form.:
C20H22N2O6
Mol. Mass.:
386.3985
SMILES:
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O
Structure:
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