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CHEBI:82762 - 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol

ChEBI IDCHEBI:82762
ChEBI Name1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol
Stars
ASCII Name1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol
Definition1-acyl-2-arachidonoyl-sn-glycero-3-phospho-D-myo-inositol in which the 1-acyl group is specified as oleoyl.
Last Modified23 October 2015
SubmitterSteve
DownloadsMolfile
FormulaC47H81O13P
Net Charge0
Average Mass885.126
Monoisotopic Mass884.54148
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(O)O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C47H81O13P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(49)59-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)37-57-40(48)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17-19,21-22,24,28,30,39,42-47,50-54H,3-10,12,14-16,20,23,25-27,29,31-38H2,1-2H3,(H,55,56)/b13-11-,19-17-,21-18-,24-22-,30-28-/t39-,42-,43-,44+,45-,46-,47-/m1/s1
InChIKeySHIZRFSRTKXRQL-PJBFRWFCSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:82762) has functional parent arachidonic acid (CHEBI:15843)
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:82762) has functional parent oleic acid (CHEBI:16196)
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:82762) has role human metabolite (CHEBI:77746)
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:82762) is a 1-acyl-2-arachidonoyl-sn-glycero-3-phospho-D-myo-inositol (CHEBI:74577)
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:82762) is conjugate acid of 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1−) (CHEBI:78765)
Incoming Relation(s)
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol(1−) (CHEBI:78765) is conjugate base of 1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol (CHEBI:82762)
IUPAC Name 
(2R)-1-[(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)oxy]-3-[(9Z)-octadec-9-enoyloxy]propan-2-yl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
Synonyms  Source
1-(9Z)-octadecenoyl-2-(5Z,8Z,11Z,14Z)-icosatetraenoyl-sn-glycero-3-phospho-1D-myo-inositoChEBI
1-(9Z)-octadecenoyl-2-(5Z,8Z,11Z,14Z)-eicosatetraenoyl-sn-glycero-3-phospho-1D-myo-inositolChEBI
PI(18:1(9Z)/20:4(5Z,8Z,11Z,14Z))LIPID MAPS
PI(18:1/20:4)LIPID MAPS
1-(9Z-octadecenoyl)-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-glycero-3-phospho-(1'- myo-inositol)LIPID MAPS
PI(18:1/20:4)HMDB
Manual XrefsDatabases
LMGP06010849LIPID MAPS
HMDB0009844HMDB