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Chemical structure of PtdIns-(4)-P1 (1,2-dioctanoyl) (ammonium salt)

GC44759

PtdIns-(4)-P1 (1,2-dioctanoyl) (ammonium salt)

Also known as diazanium;[(2S,3R,5R,6R)-4-[[(2R)-2,3-di(octanoyloxy)propoxy]-oxidophosphoryl]oxy-2,3,5,6-tetrahydroxycyclohexyl] hydrogen phosphate

The phosphatidylinositol (PtdIns) phosphates represent a small percentage of total membrane phospholipids

ChemicalCAS1246303-11-6MW700.7FormulaC25H46O16P22NH4
CAS number
1246303-11-6
Molecular weight
700.7
Formula
C25H46O16P22NH4
Solubility
Soluble in DMSO
InChIKey
GRYUDEZZGXKOJR-XMXDBXOESA-N
Catalogue number
GC44759
Brand
GLPBIO
Computed properties PubChem CID 132285272 · TPSA 264 Ų · H-bond donors 7 · H-bond acceptors 16
TPSA
264 Ų
H-bond donors
7
H-bond acceptors
16
Rotatable bonds
24
Heavy atoms
45

SMILES CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC1[C@@H]([C@H](C([C@H]([C@H]1O)O)OP(=O)(O)[O-])O)O)OC(=O)CCCCCCC.[NH4+].[NH4+]

Computed descriptors from PubChem (CID 132285272), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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