Basic information
- CAS
85733-91-1- Standard SMILES
CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(C)=O- InChIKey
ZXCIEWBDUAPBJF-UHFFFAOYSA-N- Molecular formula
- C28H58NO7P
- Average molar mass
- 551.7 g/mol
- Monoisotopic mass
- 551.39509019
Overview
reported to have same biological activity as natural PAF-acether; RN given refers to parent cpd without isomeric designation
Names & identifiers
- Preferred name
- 3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, inner salt, 4-oxide
- IUPAC
- (2-acetyloxy-3-octadecoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
- English name
- 1-0-octadecyl 2-0-acetyl sn-glycero-3-phosphorylcholine
- Molecular formula
- C28H58NO7P
- Molecular weight
- 551.736381
Names & synonyms
85733-91-11-0-octadecyl 2-0-acetyl sn-glycero-3-phosphorylcholineDTXSID501110671octadecyl PAFoctadecyl-AGPC3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, inner salt, 4-oxideoctadecyl-PAF-acetherRefChem:910672DTXCID4014669281-O-Octadecyl-2-O-acetyl-sn-glyceryl-3-phosphorylcholineBlood platelet activating factor-aetherPlatelet Activating Factor C-18
Show more names
(2-acetyloxy-3-octadecoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate1-Stearyl-2-O-acetyl-3-glyceryl phosphorylcholine(+-)-1-O-Octadecyl-2-acetylglyceryl-3-phosphorylcholine3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-, hydroxide, inner salt, 4-oxideCHEMBL12852SCHEMBL34464893PC O-18:0_2:0DB-055871
Database identifiers
- CAS
85733-91-1- PubChem CID
- 2501
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 94.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 28
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 575
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
Drugs used to cause dilation of the blood vessels.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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