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Chemical structure of 8-iso-13,14-dihydro-15-keto Prostaglandin F2α

GC40588

8-iso-13,14-dihydro-15-keto Prostaglandin F2α

Also known as (Z)-7-[(1S,2R,3R,5S)-3,5-dihydroxy-2-(3-oxooctyl)cyclopentyl]hept-5-enoic acid

8-iso-13,14-dihydro-15-keto Prostaglandin F2α (8-iso-13,14-dihydro-15-keto PGF2α) is a metabolite of the isoprostane, 8-isoprostane (8-iso PGF2α), in rabbits, monkeys and humans

ChemicalCAS191919-02-5MW354.5FormulaC20H34O5
CAS number
191919-02-5
Molecular weight
354.5
Formula
C20H34O5
Solubility
10 mM Na2CO3： >6·5 mg/ml (from PGF2a),DMF： >100 mg/ml (from PGF2a),DMSO： >100 mg/ml (from PGF2a),Ethanol： >100 mg/ml (from PGF2a),PBS pH 7·2： >10 mg/ml (from PGF2a)
InChIKey
VKTIONYPMSCHQI-JPRPWBOBSA-N
Catalogue number
GC40588
Brand
GLPBIO
Computed properties PubChem CID 5283214 · XLogP 2.6 · TPSA 94.8 Ų · H-bond donors 3
XLogP
2.6
TPSA
94.8 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
13
Heavy atoms
25

SMILES CCCCCC(=O)CC[C@H]1[C@@H](C[C@@H]([C@H]1C/C=C\CCCC(=O)O)O)O

Computed descriptors from PubChem (CID 5283214), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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