13-cis-retinal

Ligand id: 6671

Name: 13-cis-retinal

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 17.07
Molecular weight 284.21
XLogP 6.34
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenal
Synonyms
13-cis-retinal
13-cis-retinaldehyde
Database Links
CAS Registry No. 472-86-6 (source: Scifinder)
ChEBI CHEBI:45487
ChEMBL Ligand CHEMBL1579130
Human Metabolome Database HMDB06220
PubChem CID 6436079
Search Google for chemical match using the InChIKey NCYCYZXNIZJOKI-HWCYFHEPSA-N
Search Google for chemicals with the same backbone NCYCYZXNIZJOKI