CHEBI:78994 - 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ,5ʼ-bisphosphate)(5−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ,5ʼ-bisphosphate)(5−)
ChEBI ID CHEBI:78994
ChEBI ASCII Name 1,2-dipalmitoyl-sn-glycero-3-phospho-(1'-D-myo-inositol-3',5'-bisphosphate)(5-)
Definition A 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5−) arising from deprotonation of all five free phosphate OH groups of 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ,5ʼ-bisphosphate); major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C41H76O19P3
Net Charge -5
Average Mass 965.95480
Monoisotopic Mass 965.42211
InChI InChI=1S/C41H81O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)55-31-33(57-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-56-63(53,54)60-41-37(45)39(58-61(47,48)49)36(44)40(38(41)46)59-62(50,51)52/h33,36-41,44-46H,3-32H2,1-2H3,(H,53,54)(H2,47,48,49)(H2,50,51,52)/p-5/t33-,36-,37-,38-,39-,40+,41-/m1/s1
InChIKey UZMPYXSDDZXMAI-LNNNXZRXSA-I
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)O[C@H]1[C@H](O)[C@@H](OP([O-])([O-])=O)[C@H](O)[C@@H](OP([O-])([O-])=O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCC
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5-) )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ,5ʼ-bisphosphate)(5−) (CHEBI:78994) is a 1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5−) (CHEBI:57923)
1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ,5ʼ-bisphosphate)(5−) (CHEBI:78994) is conjugate base of 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ,5ʼ-bisphosphate) (CHEBI:82954)
Incoming 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼD-myo-inositol-3ʼ,5ʼ-bisphosphate) (CHEBI:82954) is conjugate acid of 1,2-dipalmitoyl-sn-glycero-3-phospho-(1ʼ-D-myo-inositol-3ʼ,5ʼ-bisphosphate)(5−) (CHEBI:78994)
IUPAC Name
(2R)-2,3-bis(palmitoyloxy)propyl (1S,2R,3R,5S,6R)-2,4,6-trihydroxy-3,5-bis(phosphonatooxy)cyclohexyl phosphate
Synonym Source
1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,5-phosphate) UniProt
Citation Waiting for Citations Type Source
9811604 PubMed citation SUBMITTER
Last Modified
10 March 2017