Blood platelet-activating factor
Basic information
- CAS
65154-06-5- Standard SMILES
CCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(C)=O- InChIKey
OLGKYSVSAKLUHK-GFCCVEGCSA-N- Molecular formula
- C12H26NO7P
- Average molar mass
- 327.31 g/mol
- Monoisotopic mass
- 327.14468917
Overview
PC(O-2:0/2:0) is an alkylacylglycero-3-phosphocholine.
Names & identifiers
- Preferred name
- Blood platelet-activating factor
- IUPAC
- [(2R)-2-acetyloxy-3-ethoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
- English name
- 1-O-Hexadecyl-2-acetyl-sn-glycero-3-phosphocholine
- Molecular formula
- C26H54NO7P
- Molecular weight
- 523.68
Names & synonyms
Platelet activating factor phosphatidateDTXSID00215470PAF-PARefChem:917387DTXCID00137961Blood platelet-activating factor, 2-((1H-inden-7-yloxy)methyl)-, (R)-65154-06-5Blood platelet-activating factor[(2R)-2-acetyloxy-3-ethoxypropyl] 2-(trimethylazaniumyl)ethyl phosphateAntihypertensive polar renomedullary lipidBlood platelet activating factor - acetherPC(O-2:0/2:0)
Show more names
PAFAprlagepcACGEPCC16PAFPAF (C16)Aids029695Aids-029695paf-acetherC16-02:0 PC
1-ethyl-2-acetyl-sn-glycero-3-phosphocholineSCHEMBL15263707CHEBI:178399OLGKYSVSAKLUHK-GFCCVEGCSA-NPC O-4:0LMGP01020121PC O-2:0/2:0PAF; Platelet-activating factor; PC(O-4:0); PC(O-2:0/2:0)
Database identifiers
- CAS
65154-06-5
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 94.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 348
Experimental & physicochemical properties
LipidsLipids -> Glycerophospholipids [GP] -> Glycerophosphocholines [GP01] -> 1-alkyl,2-acylglycerophosphocholines [GP0102]
Physicochemical properties
- storage temp.
- -20 °C · -20°C
- form
- lyophilized powder
- Merck
- 13 · 13,7607
- BRN
- 4220745 · 4220745
- InChI
- 1S/C26H54NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-31-23-26(34-25(2)28)24-33-35(29,30)32-22-20-27(3,4)5/h26H,6-24H2,1-5H3/t26-/m1/s1
- InChIKey
- HVAUUPRFYPCOCA-AREMUKBSSA-N
- SMILES
- [O-]P(OCC[N+](C)(C)C)(OC[C@]([H])(OC(C)=O)COCCCCCCCCCCCCCCCC)=O
- UNSPSC Code
- 12352211 · 12352211
- NACRES
- 77 · NA.77
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-38-40-48/20/22-67-36/38-20-63
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-21
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- rtecs
- EC6060000
- ridadr
- UN 1888 6.1/PG 3
- risk_code
- 22-38-40-48/20/22-67-36/38-20-63
- hazard_code
- Xn
- safety_code
- 36/37-26
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
General DescriptionPlatelet-activating factor (PAF; 1-O-alkyl-2-acetyl-sn-glycero-3-phosphocholine), an endogenous phospholipid is synthesized by several cells. PAF is a phosphatidylcholine derivative.
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Compound notes
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