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8-iso Prostaglandin E1

CAT: 0804-HY-118094-01Size: 500 µgDry Ice: NoHazardous: No
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CAT#:0804-HY-118094-01Size:500 µg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
8-iso Prostaglandin E1 (Ovinonic acid; 8-iso-PGE1) is a spasmodic agent in canine pulmonary veins and can also cause vasodilation[1].
CAS Number
21003-46-3
Product Name Alternative
Ovinonic acid; 8-iso-PGE1
UNSPSC
12352211
Hazard Statement
H302-H315-H319-H335
Target
Prostaglandin Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein
Applications
Neuroscience-Neuromodulation
Field of Research
Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/8-iso-prostaglandin-e1.html
Solubility
10 mM in DMSO
Smiles
OC(CCCCCC[C@H]1[C@H]([C@@H](CC1=O)O)/C=C/[C@@H](O)CCCCC)=O
Molecular Formula
C20H34O5
Molecular Weight
354.48
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Janssen LJ, et al. Vasoconstrictor actions of isoprostanes via tyrosine kinase and Rho kinase in human and canine pulmonary vascular smooth muscles. Br J Pharmacol. 2001 Jan;132 (1) :127-34.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

(8beta,11alpha,13E,15S)-11,15-Dihydroxy-9-oxoprost-13-en-1-oic acid

8-Isoprostaglandin E1 is a prostanoid.

CAS Number21003-46-3
PubChem CID5283212
IUPAC Name7-[(1S,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid
Molecular FormulaC20H34O5
Molecular Weight354.5
XLogP3.2
Topological Polar Surface Area94.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count25
Formal Charge0
Complexity432
SMILES
CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@H]1CCCCCCC(=O)O)O)O
InChI
InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16-,17+,19+/m0/s1
InChIKey
GMVPRGQOIOIIMI-JCPCGATGSA-N
Chemical Structure
2D Structure
2D structure of (8beta,11alpha,13E,15S)-11,15-Dihydroxy-9-oxoprost-13-en-1-oic acid
CAS: 21003-46-3
CID: 5283212
Formula: C20H34O5
MW: 354.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.5
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass354.24062418
Monoisotopic Mass354.24062418
Topological Polar Surface Area94.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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