Structure Database (LMSD)
Common Name
13,14-dihydro-20-hydroxy-15-oxoprostaglandin F2alpha
Systematic Name
9S,11R,20-trihydroxy-15-oxo-5Z-prostenoic acid
Synonyms
- 13,14-dihydro-20-hydroxy-15-oxo-PGF2alpha
- omega-hydroxy 15KD PGF2alpha
LM ID
LMFA03010267
Formula
Exact Mass
Calculate m/z
370.235541
Sum Composition
Status
Curated
3D model of 13,14-dihydro-20-hydroxy-15-oxoprostaglandin F2alpha
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
References
String Representations
InChiKey (Click to copy)
ZIJIPTKNEYZBMK-CBFBGTOSSA-N
InChi (Click to copy)
InChI=1S/C20H34O6/c21-13-7-3-4-8-15(22)11-12-17-16(18(23)14-19(17)24)9-5-1-2-6-10-20(25)26/h1,5,16-19,21,23-24H,2-4,6-14H2,(H,25,26)/b5-1-/t16-,17-,18+,19-/m1/s1
SMILES (Click to copy)
[C@H]1(CCC(=O)CCCCCO)[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O
Calculated Physicochemical Properties
Heavy Atoms
26
Rings
1
Aromatic Rings
Rotatable Bonds
14
Van der Waals Molecular Volume
387.02
Topological Polar Surface Area
115.06
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
6
logP
3.31
Molar Refractivity
100.16
Admin
Created at
29th Jul 2025
Updated at
29th Jul 2025