resiniferatoxin

Ligand id: 2491

Name: resiniferatoxin

Abbreviated name: RTX

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 120.75
Molecular weight 628.27
XLogP 4.6
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
Database Links
BindingDB Ligand 20285
CAS Registry No. 57444-62-9 (source: Scifinder)
ChEMBL Ligand CHEMBL17976
PubChem CID 5702546
RCSB PDB Ligand 6EU
Search Google for chemical match using the InChIKey DSDNAKHZNJAGHN-MXTYGGKSSA-N
Search Google for chemicals with the same backbone DSDNAKHZNJAGHN
Wikipedia Resiniferatoxin
Comments
Resiniferatoxin, an extract from resin spurge (Euphorbia resinifera), is a TRPV1 agonist.
There is some ambiguity online and in the literature as to the exact stereochemistry of resiniferatoxin. The representation shown here matches that in the PubChem and ChEMBL links above, while several tautomers and stereoisomers are also listed on PubChem, and ChEBI represents the compound with the entry CHEBI:8809.