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Chemical structure of 6α-Prostaglandin I1

GC40585

6α-Prostaglandin I1

Also known as 5-[(2R,4R)-5-hydroxy-4-(3-hydroxyoct-1-enyl)-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]furan-2-yl]pentanoic acid

6α-Prostaglandin I1 (6α-PGI1) is a stable Prostaglandin I2 (PGI2) analog resistant to hydrolysis in aqueous solutions

ChemicalCAS62777-90-6MW354.5FormulaC20H34O5
CAS number
62777-90-6
Molecular weight
354.5
Formula
C20H34O5
Solubility
DMF： >10 (from (6b–PGI1),DMSO： >5 (from (6b–PGI1),Ethanol： >20 mg/ml (from (6b–PGI1),PBS pH 7·2： >80 μ g (from (6b–PGI1)
InChIKey
RJADQDXZYFCVHV-LISLVGOVSA-N
Catalogue number
GC40585
Brand
GLPBIO
Computed properties PubChem CID 57369790 · XLogP 2.9 · TPSA 87 Ų · H-bond donors 3
XLogP
2.9
TPSA
87 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
25

SMILES CCCCCC(C=C[C@@H]1C2C[C@H](OC2CC1O)CCCCC(=O)O)O

Computed descriptors from PubChem (CID 57369790), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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