15-Deoxy-PGJ2

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Show 3-D Structure

15-Deoxy-PGJ2
Systematic (IUPAC) name
(Z)-7-[(1S,5E)-5-[(E)-oct-2-enylidene]-4-oxo-1-cyclopent-2-enyl]hept-5-enoic acid
Identifiers
CAS number  ?
ATC code  ?
PubChem 5311211
Chemical data
Formula C20H28O3
Mol. mass 316.43
SMILES eMolecules & PubChem
Pharmacokinetic data
Bioavailability  ?
Metabolism  ?
Half life  ?
Excretion  ?
Therapeutic considerations
Pregnancy cat.

?

Legal status
Routes  ?

15-deoxy-PGJ2 is also available; check for double bonds (indicated by delta) at 12 and 14 positions

[edit] General Properties

*Molecular Weight

316.43

*Molecular Formula

C20H28O3

*IUPAC NAME

(Z)-7-[(1S,5E)-5-[(E)-oct-2-enylidene]-4-oxo-1-cyclopent-2-enyl]hept-5-enoic acid

*Canonical Smiles

CCCCCC=CC=C1C(C=CC1=O)CC=CCCCC(=O)O

*Isomeric Smiles

CCCCCC=CC=C1/[C@H](C=CC1=O)CC=C/CCCC(=O)O


[edit] PhysioChemical Properties

*Melting Point


*LogP


*Water Solubility


[edit] External Links

  • [1]Pubchem
  • [2]KEGG Compound
  • [3]Human Metabolome DataBase