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(±) 13 (14) -EpDPA

CAT: 0804-HY-130419Size: 25 μg (290.28 μM x 250 μL in Ethanol)Dry Ice: NoHazardous: No
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CAT#:0804-HY-130419Size:25 μg (290.28 μM x 250 μL in Ethanol)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
(±) 13 (14) -EpDPA (13,14-EpDPE) is the product of the reaction of cytochrome P-450 epoxygenase with Docosahexaenoic Acid (DHA) . (±) 13 (14) -EpDPA has antihyperalgesic and vasorelaxative activities[1].
CAS Number
895127-64-7
Product Name Alternative
13,14-EpDPE
UNSPSC
12352005
Target
Cytochrome P450
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Field of Research
Neurological Disease; Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/racemic-13-14-epdpa.html
Concentration
290.28 μM * 250 μL in Ethanol
Purity
95.0
Smiles
O=C(O)CC/C=C\C/C=C\C/C=C\CC1OC1C/C=C\C/C=C\CC
Molecular Formula
C22H32O3
Molecular Weight
344.49
References & Citations
[1]Christophe Morisseau, et al. Naturally occurring monoepoxides of eicosapentaenoic acid and docosahexaenoic acid are bioactive antihyperalgesic lipids. J Lipid Res. 2010 Dec;51 (12) :3481-90.
Shipping Conditions
Blue Ice
Storage Conditions
Solution, -20°C, 2 years
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

(+/-)13(14)-EpDPA
CAS Number895127-64-7
PubChem CID124407158
IUPAC Name(4Z,7Z,10Z)-12-[(2S,3R)-3-[(2Z,5Z)-octa-2,5-dienyl]oxiran-2-yl]dodeca-4,7,10-trienoic acid
Molecular FormulaC22H32O3
Molecular Weight344.5
XLogP5.3
Topological Polar Surface Area49.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count14
Heavy Atom Count25
Formal Charge0
Complexity497
SMILES
CC/C=C\C/C=C\C[C@@H]1[C@@H](O1)C/C=C\C/C=C\C/C=C\CCC(=O)O
InChI
InChI=1S/C22H32O3/c1-2-3-4-5-11-14-17-20-21(25-20)18-15-12-9-7-6-8-10-13-16-19-22(23)24/h3-4,6-7,10-15,20-21H,2,5,8-9,16-19H2,1H3,(H,23,24)/b4-3-,7-6-,13-10-,14-11-,15-12-/t20-,21+/m1/s1
InChIKey
DCFKVKFLEPMEGT-VABGYXHOSA-N
Chemical Structure
2D Structure
2D structure of (+/-)13(14)-EpDPA
CAS: 895127-64-7
CID: 124407158
Formula: C22H32O3
MW: 344.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.5
XLogP35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count14
Exact Mass344.23514488
Monoisotopic Mass344.23514488
Topological Polar Surface Area49.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity497
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count5
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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