CHEBI:72834 - 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−)
ChEBI ID CHEBI:72834
ChEBI ASCII Name 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1-)
Definition A 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1−) obtained by deprotonation of the phosphate OH group of 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter abridge
Supplier Information No supplier information found for this compound.
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Formula C45H78O13P
Net Charge -1
Average Mass 858.069
Monoisotopic Mass 857.51855
InChI InChI=1S/C45H79O13P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(47)57-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)35-55-38(46)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h11,13,17-18,20,22,26,28,37,40-45,48-52H,3-10,12,14-16,19,21,23-25,27,29-36H2,1-2H3,(H,53,54)/p-1/b13-11-,18-17-,22-20-,28-26-/t37-,40-,41-,42+,43-,44-,45-/m1/s1
InChIKey KIQYUSYSJTUGFZ-LSLODQAYSA-M
SMILES [C@@H](OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)(COC(=O)CCCCCCCCCCCCCCC)COP(O[C@H]1[C@@H]([C@H]([C@@H]([C@H]([C@H]1O)O)O)O)O)(=O)[O-]
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(1-) )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−) (CHEBI:72834) is a 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1−) (CHEBI:75243)
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−) (CHEBI:72834) is a 1-hexadecanoyl-2-acyl-sn-glycero-3-phospho-1D-myo-inositol(1−) (CHEBI:64875)
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−) (CHEBI:72834) is a phosphatidylinositol 36:4(1−) (CHEBI:75194)
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−) (CHEBI:72834) is conjugate base of 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol (CHEBI:73209)
Incoming 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol (CHEBI:73209) is conjugate acid of 1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-icosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−) (CHEBI:72834)
IUPAC Name
(2R)-3-(hexadecanoyloxy)-2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate
Synonyms Sources
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol UniProt
1-hexadecanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycero-3-phospho-D-myo-inositol(1−) ChEBI
1-hexadecanoyl-2-arachidonoyl-sn-glycero-3-phospho-D-myo-inositol(1−) SUBMITTER
1-palmitoyl-2-arachidonoyl-GPI ChEBI
1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4) ChEBI
2-arachidonoyl-1-hexadecanoyl-sn-glycero-3-phospho-D-myo-inositol(1−) ChEBI
GPI(16:0/20:4) ChEBI
PI(16:0/20:4(5Z,8Z,11Z,14Z)) SUBMITTER
Last Modified
02 December 2016