Structure

InChI Key IYGXEHDCSOYNKY-RZHHZEQLSA-N
Smiles CCCCC[C@H](O)/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)C[C@H]1O.NC(CO)(CO)CO
InChI
InChI=1S/C20H34O5.C4H11NO3/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25;5-4(1-6,2-7)3-8/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25);6-8H,1-3,5H2/b7-4-,13-12+;/t15-,16+,17+,18-,19+;/m0./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H45NO8
Molecular Weight 475.62
AlogP 3.04
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 12.0
Polar Surface Area 97.99
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 25.0

Pharmacology

Mechanism of Action Action Reference
Prostanoid FP receptor agonist AGONIST ISBN

Target Conservation

Protein: Prostanoid FP receptor

Description: Prostaglandin F2-alpha receptor

Organism : Homo sapiens

P43088 ENSG00000122420

Cross References

Resources Reference
ChEBI 31502
ChEMBL CHEMBL1200896
DrugBank DB01160
FDA SRS CT6BBQ5A68
Guide to Pharmacology 1957
KEGG C12786
PharmGKB PA164781385
PubChem 5282415
SureChEMBL SCHEMBL203377
ZINC ZINC03830709