BDBM36086 (1S,2S,5S)-2-hydroxy-3-pinanone

SMILES CC1(C)C2CC1[C@](C)(O)C(=O)C2

InChI Key InChIKey=VZRRCQOUNSHSGB-QIMWKCOFSA-N

Data  1 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 36086   

HostPNGBDBM11(beta-cyclodextrin | betadex)
Japan Science And Technology Agency

GuestPNGBDBM36086((1S,2S,5S)-2-hydroxy-3-pinanone)
ITC DataΔG°: -4.59kcal/mole −TΔS°: 0.192kcal/mole ΔH°: -4.78kcal/mole logk: 2.31E+3
pH: 6.9 T: 25.00°C 
In DepthDetails