Epoprostenol (TN)

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 11
Total Number of Articles : 9
PubChem 5280427
Molecular Formula

C20H32O5

SMILES

CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@H]2[C@@H]1CC(=CCCCC(=O)O)O2)O)O

InChI

InChI=1S/C20H32O5/c1-2-3-4-7-14(21)10-11-16-17-12-15(8-5-6-9-20(23)24)25-19(17)13-18(16)22/h8,10-11,14,16-19,21-22H,2-7,9,12-13H2,1H3,(H,23,24)/b11-10+,15-8?/t14-,16+,17+,18+,19-/m0/s1

synonyms
  • Epoprostenol (TN)
  • 5-[(3aR,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-ylidene]pentanoic acid
  • (5Z,13E)-(15S)-6,9alpha-Epoxy-11alpha,15-dihydroxyprosta-5,13-dienoate
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Properties
Property Value
MW 352.5 g/mol
HBD 3
HBA 5
Rotatable Bond Count 10
Exact Mass 352.22497412 g/mol
Monoisotopic Mass 352.22497412 g/mol
Heavy Atom Count 25
Isotope Atom Count 0
Atom Stereo Count 5
Covalent Unit Count 1
Complexity 485
xlogp 2.9
Topological Polar Surface Area 87