Structure Database (LMSD)

Common Name
2,3,4,5-tetranor PGF3alpha
Systematic Name
9S,11S,15S trihydroxy-2,3,4,5-tetranorprosta-13,17-dienoic acid
Synonyms
  • 2,3,4,5-tetranor Prostaglandin F3alpha
  • alpha-tetnor PGF3alpha
LM ID
LMFA03010264
Formula
Exact Mass
Calculate m/z
298.178025
Sum Composition
Status
Curated

Classification

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Rattus norvegicus (#10116)
Mammalia (#40674)
The metabolism of prostaglandin F 3 in the rat.,
Biochim Biophys Acta, 1973
Pubmed ID: 4713155

String Representations

InChiKey (Click to copy)
GUIQMLJMOSHVFS-AUQOMAEESA-N
InChi (Click to copy)
InChI=1S/C16H26O5/c1-2-3-4-5-11(17)6-7-12-13(8-9-16(20)21)15(19)10-14(12)18/h3-4,6-7,11-15,17-19H,2,5,8-10H2,1H3,(H,20,21)/b4-3-,7-6+/t11-,12+,13+,14+,15-/m0/s1
SMILES (Click to copy)
[C@H]1(/C=C/[C@@H](O)C/C=C\CC)[C@H](O)C[C@H](O)[C@@H]1CCC(=O)O

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 1
Aromatic Rings
Rotatable Bonds 8
Van der Waals Molecular Volume 309.03
Topological Polar Surface Area 97.99
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
logP 2.34
Molar Refractivity 81.21

Admin

Created at
24th Jul 2025
Updated at
1st Aug 2025