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Chemical structure of Docosahexaenoyl PAF C-16

GC43557

Docosahexaenoyl PAF C-16

Also known as [(2R)-2-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-3-hexadecoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

Docosahexaenoyl PAF C-16 is a PAF analog which contains docosahexaenoate at the sn-2 position rather than the acetate moiety found in PAF C-16

ChemicalCAS132213-85-5MW792.1FormulaC46H82NO7P
CAS number
132213-85-5
Molecular weight
792.1
Formula
C46H82NO7P
Solubility
acidic PBS: 14·3 mg/ml,DMSO: >2·5 mg/ml,Ethanol: >1·7 mg/ml,PBS pH 7·2: <50 ug/ml
InChIKey
QQQQNYAHSSIZBU-HIQXTUQZSA-N
Catalogue number
GC43557
Brand
GLPBIO
Computed properties PubChem CID 16759366 · XLogP 12.9 · TPSA 94.1 Ų · H-bond donors 0
XLogP
12.9
TPSA
94.1 Ų
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
40
Heavy atoms
55

SMILES CCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

Computed descriptors from PubChem (CID 16759366), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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