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Chemical structure of Octadecylphosphophosphoniumcholine

GA23317

Octadecylphosphophosphoniumcholine

Also known as octadecyl 2-trimethylphosphaniumylethyl phosphate

Octadecylphosphophosphoniumcholine is the phosphonium homolog of octadecylphosphocholine·Octadecylphosphophosphoniumcholine has been shown to be much better tolerated than octadecylphosphocholine in rats suffering from experimental carcinom (LD??= 1·8 mmol/kg in mouse) The cytotoxic activity on carcinoma cell cultures remained as good as that of octadecylphosphocholine, with an EC?? of 6·2 µmol/L as compared to 6·4 µmol/L for octadecylphosphocholine

ChemicalCAS156825-89-7MW452.6FormulaC23H50O4P2
CAS number
156825-89-7
Molecular weight
452.6
Formula
C23H50O4P2
Solubility
Soluble in DMSO
InChIKey
LKRUUBNORFYVBG-UHFFFAOYSA-N
Catalogue number
GA23317
Brand
GLPBIO
Computed properties PubChem CID 10434026 · XLogP 7.5 · TPSA 58.6 Ų · H-bond donors 0
XLogP
7.5
TPSA
58.6 Ų
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
22
Heavy atoms
29

SMILES CCCCCCCCCCCCCCCCCCOP(=O)([O-])OCC[P+](C)(C)C

Computed descriptors from PubChem (CID 10434026), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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