Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA03010038
Common Name19R-hydroxy-PGF1α
Systematic Name9S,11R,15S,19R-tetrahydroxy-13E-prostaenoic acid
Synonyms19(R)-hydroxy-Prostaglandin F1α
Exact Mass
372.2512 (neutral)    Calculate m/z:
FormulaC20H36O6
CategoryFatty Acyls [FA]
Main ClassEicosanoids [FA03]
Sub ClassProstaglandins [FA0301]
LIPIDBANK IDXPR1718
PubChem CID5283045
CAYMAN ID15910
InChIKeyJRNZEGAFLBTZDT-IRMCVWCUSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C20H36O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-1
0-20(25)26/h11-12,14-19,21-24H,2-10,13H2,1H3,(H,25,26)/b12-11+/t14-,15+,16-,17-,
18+,19-/m1/s1
SMILES[C@H]1(/C=C/[C@@H](O)CCC[C@H](O)C)[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O
MS StandardView lipid standard
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms26Rings1Aromatic Rings0Rotatable Bonds13
 van der Waals
Molecular Volume
389.66Topological Polar
Surface Area
118.22Hydrogen
Bond Donors
5Hydrogen
Bond Acceptors
6
 logP3.38Molar
Refractivity
101.68