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Cell Reactant:BDBM4
Syringe Reactant:BDBM36120
Meas. Tech.:ITC
Entry Date:10/15/10
 
ΔG°:-1.53±0.120 (kcal/mole)
pH:6.9±0
Log10Kb:1.15± 0.301
Temperature:298.15±0 (K)
ΔH° :-5.02±0.480 (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° :-0.0100±0 (kcal/mole-K)
Comments:First trial
 
Citation Yamamura, HRekharsky, MVIshihara, YKawai, MInoue, Y Factors controlling the complex architecture of native and modified cyclodextrins with dipeptide (Z-Glu-Tyr) studied by microcalorimetry and NMR spectroscopy: critical effects of peripheral bis-trimethylamination and cavity size. J Am Chem Soc126:14224-33 (2004) [PubMed]  Article
More Info.:  Get all data from this article ,  ITC RUN data ,  Solution Info ,  Instrument Info
 
BDBM4
Source:10016-20-3
Purity:n/a
Prep. Method:n/a
NameBDBM4
Synonyms:(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.2^{3,6}.2^{8,11}.2^{13,16}.2^{18,21}.2^{23,26}]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol | alpha-cyclodextrin
TypeMolecular Host
Emp. Form.C36H60O30
Mol. Mass.972.8436
SMILES[H]C12OC(CO)C([H])(OC3([H])OC(CO)C([H])(OC4([H])OC(CO)C([H])(OC5([H])OC(CO)C([H])(OC6([H])OC(CO)C([H])(OC7([H])OC(CO)C([H])(O1)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O
Structure
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BDBM36120
Source:n/a
Purity:n/a
Prep. Method:n/a
NameBDBM36120
Synonyms:Cbz-L-Glu | Z-L-Glu
TypeGuest
Emp. Form.C13H15NO6
Mol. Mass.281.2613
SMILESOC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(O)=O
Structure
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