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CHEBI:88574 - PI(18:0/22:4(7Z,10Z,13Z,16Z))

ChEBI IDCHEBI:88574
ChEBI NamePI(18:0/22:4(7Z,10Z,13Z,16Z))
Stars
DownloadsMolfile
FormulaC49H87O13P
Net Charge0
Average Mass915.196
Monoisotopic Mass914.58843
SMILES[H][C@@](COC(=O)CCCCCCCCCCCCCCCCC)(COP(=O)(O)O[C@H]1C(O)C(O)C(O)[C@@H](O)C1O)OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC
InChIInChI=1S/C49H87O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-43(51)61-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)39-59-42(50)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,26,28,41,44-49,52-56H,3-10,12,14-16,18,20,23-25,27,29-40H2,1-2H3,(H,57,58)/b13-11-,19-17-,22-21-,28-26-/t41-,44?,45-,46?,47?,48?,49-/m1/s1
InChIKeyYHRFCKNOQBDBPJ-QPGCQHQDSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
ChEBI Ontology
Outgoing Relation(s)
PI(18:0/22:4(7Z,10Z,13Z,16Z)) (CHEBI:88574) is a phosphatidylinositol (CHEBI:28874)
Synonyms  Source
Phosphatidylinositol(18:0/22:4)HMDB
PIno(18:0/22:4w6)HMDB
PI(18:0/22:4w6)HMDB
[(2R)-2-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyloxy]-3-(octadecanoyloxy)propoxy]({[(1s,3R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})phosphinic acidHMDB
PIno(40:4)HMDB
PIno(18:0/22:4n6)HMDB
Manual XrefsDatabases
PhosphatidylinositolsMetaCyc
HMDB0009818HMDB
LecithinWikipedia
Citations