CHEBI:89300 - PI(22:5(7Z,10Z,13Z,16Z,19Z)/18:0)

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ChEBI Name PI(22:5(7Z,10Z,13Z,16Z,19Z)/18:0)
ChEBI ID CHEBI:89300
Stars This entity has been manually annotated by a third party.
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Formula C49H85O13P
Net Charge 0
Average Mass 913.167
Monoisotopic Mass 912.57278
InChI InChI=1S/C49H85O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-25-27-29-31-33-35-37-42(50)59-39-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)61-43(51)38-36-34-32-30-28-26-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,25,27,41,44-49,52-56H,3-4,6,8-10,12,14-16,18,20,23-24,26,28-40H2,1-2H3,(H,57,58)/b7-5-,13-11-,19-17-,22-21-,27-25-/t41-,44?,45-,46?,47?,48?,49-/m1/s1
InChIKey JKBGMGRETGIHEV-LHACAUHCSA-N
SMILES [C@@H]1(C(C(C([C@H](C1O)O)O)O)O)OP(OC[C@@](COC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(OC(CCCCCCCCCCCCCCCCC)=O)[H])(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: PubMed
ChEBI Ontology
Outgoing PI(22:5(7Z,10Z,13Z,16Z,19Z)/18:0) (CHEBI:89300) is a phosphatidylinositol (CHEBI:28874)
Synonyms Sources
1-(7Z,10Z,13Z,16Z,19Z-Docosapentaenoyl)-2-octadecanoyl-sn-glycero-3-phospho-(1'-myo-inositol) HMDB
1-Docosapentaenoyl-2-stearoyl-sn-glycero-3-phosphoinositol HMDB
[(2R)-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-(octadecanoyloxy)propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acid HMDB
Phosphatidylinositol(22:5/18:0) HMDB
Phosphatidylinositol(22:5n3/18:0) HMDB
Phosphatidylinositol(22:5w3/18:0) HMDB
Phosphatidylinositol(40:5) HMDB
PI(22:5/18:0) HMDB
PI(22:5n3/18:0) HMDB
PI(22:5w3/18:0) HMDB
PI(40:5) HMDB
PIno(22:5/18:0) HMDB
PIno(22:5n3/18:0) HMDB
PIno(22:5w3/18:0) HMDB
PIno(40:5) HMDB
Manual Xrefs Databases
HMDB0009919 HMDB
Lecithin Wikipedia
Phosphatidylinositols MetaCyc
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Citation Waiting for Citations Type Source
20671299 PubMed citation Europe PMC