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Chemical structure of 1a,1b-dihomo Prostaglandin E1

GC18748

1a,1b-dihomo Prostaglandin E1

Also known as 9-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]nonanoic acid

Prostaglandin E1 (PGE1) is not a major naturally occurring PG, but is widely administered clinically for several indications including peripheral occlusive vascular disease, erectile dysfunction, and in neonatal cardiology

ChemicalCAS23452-98-4MW382.5FormulaC22H38O5
CAS number
23452-98-4
Molecular weight
382.5
Formula
C22H38O5
Solubility
DMF： >100 mg/ml (from PGE1),DMSO： >50 mg/ml (from PGE1),Ethanol： >50 mg/ml (from PGE1),PBS pH 7·2： >1·6 mg/ml (from PGE1)
InChIKey
YMDDELUTDBQEMT-QZCLESEGSA-N
Catalogue number
GC18748
Brand
GLPBIO
Computed properties PubChem CID 5283099 · XLogP 4.3 · TPSA 94.8 Ų · H-bond donors 3
XLogP
4.3
TPSA
94.8 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
15
Heavy atoms
27

SMILES CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCCCC(=O)O)O)O

Computed descriptors from PubChem (CID 5283099), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Lead time
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