biliverdin

Ligand id: 5153

Name: biliverdin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 11
Topological polar surface area 160.95
Molecular weight 582.25
XLogP 3.96
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
3-[2-[(Z)-[(5E)-3-(2-carboxyethyl)-5-[(4-ethenyl-3-methyl-5-oxopyrrol-2-yl)methylidene]-4-methylpyrrol-2-ylidene]methyl]-5-[(Z)-(3-ethenyl-4-methyl-5-oxopyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid
Database Links
CAS Registry No. 114-25-0
ChEBI CHEBI:17033
ChEMBL Ligand CHEMBL455477
Human Metabolome Database HMDB01008
PubChem CID 5353439
Search Google for chemical match using the InChIKey RCNSAJSGRJSBKK-YKSNQIBWSA-N
Search Google for chemicals with the same backbone RCNSAJSGRJSBKK
Wikipedia Biliverdin
Comments
There is some ambiguity in the literature and on online resources as to the exact stereochemisitry of biliverdin. The structure shown here matches that linked to above in PubChem, but may be different to that shown in the other resources linked to. Other common representations are: CID 5280353, CID 6183357 and CID 5315455.