Cell Reactant:
BDBM11
Syringe Reactant:
BDBM18073
Meas. Tech.:
ITC
Entry Date.:
10/30/10
ΔG°:
-3±3 (kJ/mole)
pH:
5.01±0
Log10Kb:
0.8
Temperature:
298.15±0 (K)
ΔH° :
-12±22 (kJ/mole)
ΔS° :
-0.03±0.075 (kJ/mole-K)
Comments:
First trial
Citation
 Rekharsky, MVSchwarz, FPTewari, YBGoldberg, RN A Thermodynamic Study of the Reactions of Cyclodextrins with Primary and Secondary Aliphatic Alcohols, with D- and L-Phenylalanine, and with L-Phenylalanine Amide J Phys Chem 98:10282-10288 (1994)    Article
Cell React
Source:
7585-39-9
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:
Search PDB for entries with ligand similarity:
Syringe React
Source:
63-91-2
Name:
BDBM18073
Synonyms:
(2S)-2-amino-3-phenylpropanoic acid | CHEMBL301523 | L-[2,3,4,5,6-3H]phenylalanine | L-phenylalanine | Phenylalanine | US11021454, Compound L-phe
Type:
Amino Acid
Emp. Form.:
C9H11NO2
Mol. Mass.:
165.1891
SMILES:
N[C@@H](Cc1ccccc1)C(O)=O
Structure:
Search PDB for entries with ligand similarity: