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Azelaoyl PAF

CAT: 0804-HY-W127460-01Size: 1 mg (7.67 mM x 200 μL in Ethanol)Dry Ice: NoHazardous: No
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CAT#:0804-HY-W127460-01Size:1 mg (7.67 mM x 200 μL in Ethanol)
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Description
1-hexadecyl-2-azelaoyl-sn-glycero-3-phosphocholine is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
CAS Number
354583-69-0
Product Name Alternative
1-Hexadecyl-2-azelaoyl-sn-glycero-3-phosphocholine
UNSPSC
12352200
Hazard Statement
H225, H319
Target
Biochemical Assay Reagents
Type
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/azelaoyl-paf.html
Concentration
7.67 mM * 200 μL in Ethanol
Purity
95.9
Solubility
10 mM in DMSO
Smiles
CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC(=O)O
Molecular Formula
C33H66NO9P
Molecular Weight
651.85
Precautions
H225, H319
Shipping Conditions
Blue Ice
Storage Conditions
Solution, -20°C, protect from light, 2 years
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported

Chemical Information

PC(O-16:0/9:0(Cooh))

1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine is a 2-acyl-1-alkyl-sn-glycero-3-phosphocholine in which the alkyl and the acyl groups at positions 1 and 2 are specified as hexadecyl and 8-carboxyoctanoyl respectively. It has a role as a PPARgamma agonist. It is functionally related to a nonanedioic acid. It is a conjugate acid of a 1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine(1-).

CAS Number354583-69-0
PubChem CID17757205
IUPAC Name[(2R)-2-(8-carboxyoctanoyloxy)-3-hexadecoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular FormulaC33H66NO9P
Molecular Weight651.9
XLogP8.3
Topological Polar Surface Area131
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count34
Heavy Atom Count44
Formal Charge0
Complexity737
SMILES
CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC(=O)O
InChI
InChI=1S/C33H66NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27-40-29-31(30-42-44(38,39)41-28-26-34(2,3)4)43-33(37)25-22-19-17-18-21-24-32(35)36/h31H,5-30H2,1-4H3,(H-,35,36,38,39)/t31-/m1/s1
InChIKey
ZDFOCDTXDPKJKA-WJOKGBTCSA-N
Chemical Structure
2D Structure
2D structure of PC(O-16:0/9:0(Cooh))
CAS: 354583-69-0
CID: 17757205
Formula: C33H66NO9P
MW: 651.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight651.9
XLogP38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count34
Exact Mass651.44751968
Monoisotopic Mass651.44751968
Topological Polar Surface Area131 Ų
Heavy Atom Count44
Formal Charge0
Complexity737
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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