CHEBI:88559 - PI(16:2(9Z,12Z)/22:3(10Z,13Z,16Z))

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ChEBI Name PI(16:2(9Z,12Z)/22:3(10Z,13Z,16Z))
ChEBI ID CHEBI:88559
Stars This entity has been manually annotated by a third party.
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Formula C47H81O13P
Net Charge 0
Average Mass 885.114
Monoisotopic Mass 884.54148
InChI InChI=1S/C47H81O13P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-41(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)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h8,10-11,13-14,16-18,20-21,39,42-47,50-54H,3-7,9,12,15,19,22-38H2,1-2H3,(H,55,56)/b10-8-,13-11-,16-14-,18-17-,21-20-/t39-,42?,43-,44?,45?,46?,47-/m1/s1
InChIKey DMWGXPQFZLCNSP-LVRSVQNSSA-N
SMILES [C@@H]1(C(C(C([C@H](C1O)O)O)O)O)OP(OC[C@@](COC(CCCCCCC/C=C\C/C=C\CCC)=O)(OC(CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O)[H])(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed
ChEBI Ontology
Outgoing PI(16:2(9Z,12Z)/22:3(10Z,13Z,16Z)) (CHEBI:88559) is a phosphatidylinositol (CHEBI:28874)
Synonyms Sources
1-(9Z,12Z-Hexadecadienoate HMDB
1-(9Z,12Z-Hexadecadienoate)-2-(10Z,13Z,16Z-docosatrienoyl)-sn-glycero-3-phospho-(1'-myo-inositol) HMDB
1-(9Z,12Z-Hexadecadienoate)-2-(10Z,13Z,16Z-docosatrienoyl)-sn-glycero-3-phosphoinositol HMDB
1-(9Z,12Z-Hexadecadienoic acid HMDB
[(2R)-2-[(10Z,13Z,16Z)-docosa-10,13,16-trienoyloxy]-3-[(9Z,12Z)-hexadeca-9,12-dienoyloxy]propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid HMDB
Phosphatidylinositol(16:2/22:3) HMDB
Phosphatidylinositol(16:2n4/22:3n6) HMDB
Phosphatidylinositol(16:2w4/22:3w6) HMDB
Phosphatidylinositol(38:5) HMDB
PI(16:2/22:3) HMDB
PI(16:2n4/22:3n6) HMDB
PI(16:2w4/22:3w6) HMDB
PI(38:5) HMDB
PIno(16:2/22:3) HMDB
PIno(16:2n4/22:3n6) HMDB
PIno(16:2w4/22:3w6) HMDB
PIno(38:5) HMDB
Manual Xrefs Databases
HMDB0009804 HMDB
Lecithin Wikipedia
Phosphatidylinositols MetaCyc
View more database links
Citation Waiting for Citations Type Source
20671299 PubMed citation Europe PMC