Structure Database (LMSD)
Common Name
19-hydroxy-8-iso-PGF1alpha
Systematic Name
8β-9S,11R,15S,19-tetrahydroxy-13E-prostaenoic acid
Synonyms
- 19-hydroxy-8-iso-Prostaglandin F1alpha
LM ID
LMFA03010307
Formula
Exact Mass
Calculate m/z
372.251191
Sum Composition
Status
Curated
3D model of 19-hydroxy-8-iso-PGF1alpha
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)
JRNZEGAFLBTZDT-UQPUDFRRSA-N
InChi (Click to copy)
InChI=1S/C20H36O6/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/h11-12,14-19,21-24H,2-10,13H2,1H3,(H,25,26)/b12-11+/t14?,15-,16-,17+,18-,19+/m0/s1
SMILES (Click to copy)
[C@H]1(/C=C/[C@@H](O)CCCC(O)C)[C@H](O)C[C@H](O)[C@H]1CCCCCCC(=O)O
Calculated Physicochemical Properties
Heavy Atoms
26
Rings
1
Aromatic Rings
Rotatable Bonds
13
Van der Waals Molecular Volume
389.66
Topological Polar Surface Area
118.22
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
6
logP
3.38
Molar Refractivity
101.68
Admin
Created at
22nd Aug 2025
Updated at
22nd Aug 2025