Structure Database (LMSD)
Common Name
8-iso-19-hydroxy-PGF2alpha
Systematic Name
8β-9S,11R,15S,19-tetrahydroxy-5Z,13E-prostadienoic acid
Synonyms
- 8-iso-19-hydroxy-Prostaglandin F2alpha
LM ID
LMFA03110366
Formula
Exact Mass
Calculate m/z
370.235541
Sum Composition
Status
Curated
3D model of 8-iso-19-hydroxy-PGF2alpha
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)
UBWZMPMLSDJDSU-CUJNXKKZSA-N
InChi (Click to copy)
InChI=1S/C20H34O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-19,21-24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11+/t14-,15+,16+,17-,18+,19-/m1/s1
SMILES (Click to copy)
[C@H]1(/C=C/[C@@H](O)CCC[C@H](O)C)[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
12
Van der Waals Molecular Volume
387.02
Topological Polar Surface Area
118.22
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
6
logP
3.16
Molar Refractivity
101.58
Admin
Created at
22nd Aug 2025
Updated at
22nd Aug 2025