Products 204858-53-7

CAS 204858-53-7 appears in our catalog under these names: PtdIns–(4,5)–P2 (1,2–dioctanoyl), PtdIns-(4,5)-P2 (1,2-dioctanoyl). Offered by: GLPBio, MedChemExpress. Available pack sizes: 1mg, 1 mg, 500 μg.

Structural formula: {0} (CAS {1})

1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4,5-bisphosphate) is a 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate in which the phosphatidyl acyl groups at positions 1 and 2 are both specified as octanoyl. It is a 1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate and an octanoate ester. It is a conjugate acid of a 1,2-dioctanoyl-sn-glycero-3-phospho-(1D-myo-inositol-4,5-bisphosphate)(5-).

Source: ChEBI

Identity
Molecular formulaC25H49O19P3
Molecular weight746.6 g/mol
IUPAC name[(2R)-3-[hydroxy-[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-diphosphonooxycyclohexyl]oxyphosphoryl]oxy-2-octanoyloxypropyl] octanoate
InChIKeyXLNCEHRXXWQMPK-MJUMVPIBSA-N
SMILESCCCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1O)OP(=O)(O)O)OP(=O)(O)O)O)O)OC(=O)CCCCCCC

Computed by PubChem (NCBI)