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2-[(2-Acetyloxy-3-hexadecoxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium

HCID 2500
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
77286-68-1
Standard SMILES
CCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC(C)=O
InChIKey
HVAUUPRFYPCOCA-UHFFFAOYSA-O
Molecular formula
C26H55NO7P+
Average molar mass
524.7 g/mol
Monoisotopic mass
524.37161509

Names & identifiers

Preferred name
2-[(2-Acetyloxy-3-hexadecoxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium
IUPAC
2-[(2-acetyloxy-3-hexadecoxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium
English name
1-O-Hexadecyl-2-acetyl-rac-glycero-3-phosphocholine
Molecular formula
C26H54NO7P
Molecular weight
523.68

Names & synonyms

rac-Platelet activating factor2-[(2-acetyloxy-3-hexadecoxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazaniumPaf enantiomerorb2279727SCHEMBL12235513DTXSID102743711-O-Palmityl-2-acetyl-rac-glycero-3-phosphocholine, ~99%7-(Acetyloxy)-4-hydroxy-N,N,N-trimethyl-4-oxo-3,5,9-trioxa-4lambda~5~-phosphapentacosan-1-aminium1-O-hexadecyl-2-acetyl-rac-glycero-3-phosphateDL-α-Phosphatidylcholine, β-acetyl-γ-O-hexadecyl1-O-Hexadecyl-2-acetyl-3-phosphatidylcholine (PAF)2-Acetyl-1-O-hexadecyl-3-phosphatidylcholine (PAF)
Show more names
1-o-palmityl-2-acetyl-rac-glycero-3-phosphocholine1-o-Hexadecyl-2-acetyl-rac-glycero-3-phosphochline1-O-Hexadecyl-2-acetyl-rac-glycero-3-phosphocholineDL-A-PHOSPHATIDYLCHOLINE, B-ACETYL-*GAMM A-O-HEXADECBETA-ACETYL-GAMMA-O-HEXADECYL DL-A-PHOSPHATIDYLCHOLINE

Properties

Computed structural properties

XLogP
6.6
Topological polar surface area
91.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
26
Heavy atoms
35
Formal charge
1
Complexity
554

Physicochemical properties

storage temp.
20 °C · −20°C
WGK Germany
3 · 3

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

wgk
3

Chemistry & industry

Suppliers2 total

苏州昊帆生物股份有限公司0512-68417696 13732629933 · [email protected]
佛山合硕医药科技有限公司15363639686 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
77286-68-1
PubChem CID
2500
DTXSID
DTXSID10274371