vialinin A

Ligand id: 8669

Name: vialinin A

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 4
Rotatable bonds 10
Topological polar surface area 133.52
Molecular weight 562.16
XLogP 9.18
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
IUPAC Name
[3,4-dihydroxy-2,5-bis(4-hydroxyphenyl)-6-(2-phenylacetyl)oxyphenyl] 2-phenylacetate
Synonyms
ganbajunin C
Database Links
CAS Registry No. 858134-23-3 (source: PubChem)
ChEMBL Ligand CHEMBL2012938
PubChem CID 11563133
Search Google for chemical match using the InChIKey NOJUKCRPSUMHQQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NOJUKCRPSUMHQQ
Search UniChem for chemical match using the InChIKey NOJUKCRPSUMHQQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NOJUKCRPSUMHQQ
Comments
Vialinin A, a naturally ocurring compound extracted from the Chinese mushroom Thelephora vialis, is reported to inhibit ubiquitin-specific peptidases [1]. Vialinin A exhibits a potent anti-inflammatory effect.