anacardic acid

Ligand id: 6999

Name: anacardic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 13
Topological polar surface area 57.53
Molecular weight 342.22
XLogP 8.94
No. Lipinski's rules broken 2

Molecular properties generated using the CDK
Classification
Compound class Natural product or derivative
IUPAC Name
2-hydroxy-6-[(8E,11E)-pentadeca-8,11,14-trien-1-yl]benzoic acid
Comments
Anacardic acid has been ascribed activity as a histone acetyltransferase (HAT) inhibitor. However, a 2017 article by Dahlin et al. suggests that anacardic acid non-specifically perturbs biological assays, bringing in to question its HAT inhibitor activity [2].
Database Links
CAS Registry No. 18654-18-7
ChEMBL Ligand CHEMBL464925
GtoPdb PubChem SID 178103578
PubChem CID 5388781
Search Google for chemical match using the InChIKey QUVGEKPNSCFQIR-AOSYACOCSA-N
Search Google for chemicals with the same backbone QUVGEKPNSCFQIR
Search UniChem for chemical match using the InChIKey QUVGEKPNSCFQIR-AOSYACOCSA-N
Search UniChem for chemicals with the same backbone QUVGEKPNSCFQIR