4α-PDH

Ligand Id: 4105
Ligand name 4α-PDH

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 13
Topological polar surface area 130.36
Molecular weight 560.33
XLogP 3.92
No. Lipinski's rules broken 1

Molecular properties generated using the CDK


Classification
Compound class Synthetic organic
IUPAC Name
(1S,2S,6S,10S,11R,13S,14R,15R)-14-(hexanoyloxy)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0^{2,6}.0^{11,13}]pentadeca-3,8-dien-13-yl hexanoate
Synonyms
4α-phorbol 12,13-dihexanoate
Database Links
PubChem CID 42638006
Search Google for chemical match using the InChIKey XGPRSRGBAHBMAF-QYSBVNMQSA-N
Search Google for chemicals with the same backbone XGPRSRGBAHBMAF