Structure Database (LMSD)

Common Name
13,14-dihydro 2,3,4,5-tetranor- PGF2alpha
Systematic Name
9S,11R,15S-trihydroxy-5Z-2,3,4,5-tetranor-prostenoic acid
Synonyms
  • 13,14-dihydro 2,3,4,5-tetranor-Prostaglandin F2alpha
LM ID
LMFA03010294
Formula
C16H30O5
Exact Mass
Calculate m/z
302.209326
Sum Composition
FA 16:1;O3
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Eicosanoids [FA03]
Prostaglandins [FA0301]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Oryctolagus cuniculus (#9986)
Mammalia (#40674)
Metabolism of prostaglandin F 2 in the rabbit.,
Eur J Biochem, 1972
Pubmed ID: 5050256

String Representations

InChiKey (Click to copy)
CNYMPVABNKTKPR-JARUQAPTSA-N
InChi (Click to copy)
InChI=1S/C16H30O5/c1-2-3-4-5-11(17)6-7-12-13(8-9-16(20)21)15(19)10-14(12)18/h11-15,17-19H,2-10H2,1H3,(H,20,21)/t11-,12+,13+,14+,15-/m0/s1
SMILES (Click to copy)
[C@H]1(CC[C@@H](O)CCCCC)[C@H](O)C[C@H](O)[C@@H]1CCC(=O)O

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 1
Aromatic Rings
Rotatable Bonds 10
Van der Waals Molecular Volume 314.31
Topological Polar Surface Area 97.99
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
logP 2.79
Molar Refractivity 81.40

Admin

Created at
15th Aug 2025
Updated at
15th Aug 2025