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Chemical structure of 15-deoxy-δ12,14-Prostaglandin D2

GC41102

15-deoxy-δ12,14-Prostaglandin D2

Also known as 7-[(1R,5R)-5-hydroxy-2-oct-2-enylidene-3-oxocyclopentyl]hept-5-enoic acid

15-deoxy-δ12,14-PGD2 is a synthetic analog of PGD2 and a potential precursor to the PPARγ ligand 15-deoxy-δ12,14-PGJ2

ChemicalCAS85235-11-6MW334.5FormulaC20H30O4
CAS number
85235-11-6
Molecular weight
334.5
Formula
C20H30O4
Solubility
DMF： >100 mg/ml (from PGD2),DMSO： >50 mg/ml (from PGD2),Ethanol： >75 mg/ml (from PGD2),PBS pH 7·2： >5 mg/ml (from PGD2)
InChIKey
QUGBPWLPAUHDTI-IEBWSBKVSA-N
Catalogue number
GC41102
Brand
GLPBIO
Computed properties PubChem CID 121232839 · XLogP 3.8 · TPSA 74.6 Ų · H-bond donors 2
XLogP
3.8
TPSA
74.6 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
24

SMILES CCCCCC=CC=C1[C@H]([C@@H](CC1=O)O)CC=CCCCC(=O)O

Computed descriptors from PubChem (CID 121232839), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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