CHEBI:82963 - 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ-phosphate)

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ChEBI Name 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ-phosphate)
ChEBI ID CHEBI:82963
ChEBI ASCII Name 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'D-myo-inositol-3'-phosphate)
Definition A 1-phosphatidyl-1D-myo-inositol 3-phosphate in which both phosphatidyl acyl groups are specified as palmitoyl (hexadecanoyl).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C41H80O16P2
Net Charge 0
Average Mass 891.01180
Monoisotopic Mass 890.49216
InChI InChI=1S/C41H80O16P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)53-31-33(55-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-54-59(51,52)57-41-38(46)36(44)37(45)40(39(41)47)56-58(48,49)50/h33,36-41,44-47H,3-32H2,1-2H3,(H,51,52)(H2,48,49,50)/t33-,36+,37+,38-,39-,40-,41+/m1/s1
InChIKey SZPQTEWIRPXBTC-KFOWTEFUSA-N
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](OP(O)(O)=O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCC
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via 1-phosphatidyl-1D-myo-inositol 3-phosphate )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ-phosphate) (CHEBI:82963) has functional parent hexadecanoic acid (CHEBI:15756)
1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ-phosphate) (CHEBI:82963) is a 1,2-dipalmitoylglycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ-phosphate) (CHEBI:82948)
1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ-phosphate) (CHEBI:82963) is a 1-phosphatidyl-1D-myo-inositol 3-phosphate (CHEBI:17283)
IUPAC Name
(2R)-3-[(hydroxy{[(1S,2R,3S,4S,5R,6R)-2,3,4,6-tetrahydroxy-5-(phosphonooxy)cyclohexyl]oxy}phosphoryl)oxy]propane-1,2-diyl dihexadecanoate
Synonyms Sources
1,2-dihexadecanoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ-phosphate) ChEBI
PIP[3'](16:0/16:0) ChEBI
Registry Number Type Source
8136657 Reaxys Registry Number Reaxys
Last Modified
17 September 2014