acetyl-podocarpic dimer

Ligand id: 2753

Name: acetyl-podocarpic dimer

Abbreviated name: APD

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 95.97
Molecular weight 614.32
XLogP 11.39
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[(1S,4aS,10aR)-6-acetyloxy-1,4a-dimethyl2,3,4,9,10,10a-hexahydrophenanthrene-1-carbonyl] (1S,4aS,10aR)-6-acetyloxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate
Synonyms
acetyl podocarpic acid anhydride
Database Links
BindingDB Ligand 50241903
CAS Registry No. 344327-48-6
ChEMBL Ligand CHEMBL506838
PubChem CID 9830426
Search Google for chemical match using the InChIKey OUJQRQRBNRGQTC-SPGSYPTKSA-N
Search Google for chemicals with the same backbone OUJQRQRBNRGQTC