[3H]9-cis-retinoic acid

Ligand id: 5383

Name: [3H]9-cis-retinoic acid    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 37.3
Molecular weight 300.21
XLogP 6.25
No. Lipinski's rules broken 1

Molecular properties generated using the CDK
Classification
Compound class Synthetic organic
IUPAC Name
(2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid
Synonyms
[3H]-9-cis-retinoic acid
Database Links
ChEMBL Ligand CHEMBL705
GtoPdb PubChem SID 178102041
PubChem CID 449171
RCSB PDB Ligand 9CR
Search Google for chemical match using the InChIKey SHGAZHPCJJPHSC-ZVCIMWCZSA-N
Search Google for chemicals with the same backbone SHGAZHPCJJPHSC
Search UniChem for chemical match using the InChIKey SHGAZHPCJJPHSC-ZVCIMWCZSA-N
Search UniChem for chemicals with the same backbone SHGAZHPCJJPHSC