Ligand
Ligand Name:   (±)19,20-epoxy-4Z,7Z,10Z,13Z,16Z-docosapentaenoic acid
Ligand Type:   non-polymer
Ligand ID:   COVPDB363 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   CC[C@H]1O[C@@H]1C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCC(O)=O
Standard InChI:   InChI=1S/C22H32O3/c1-2-20-21(25-20)18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-22(23)24/h3-4,7-10,13-16,20-21H,2,5-6,11-12,17-19H2,1H3,(H,23,24)/b4-3-,9-7-,10-8-,15-13-,16-14-/t20-,21-/m1/s1
Molecular Formula:   C22H32O3 Mol. Weight:   344.23514 logP:   5.7601
HBD:   1 HBA:   2
#Rotatable Bonds:   14 TPSA:   49.83

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Putative hydrolase A0A0H2ZD27 (A0A0H2ZD27_PSEAB) Pseudomonas aeruginosa (strain UCBPP-PA14) 5TNF 7HW
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