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CHEBI:133456 - 1-α-linolenoyl-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:133456
ChEBI Name1-α-linolenoyl-sn-glycero-3-phosphocholine
Stars
ASCII Name1-alpha-linolenoyl-sn-glycero-3-phosphocholine
DefinitionA PC(18:3/0:0) in which the 1-acyl group is specified as α-linolenoyl.
Last Modified6 May 2021
SubmitterSteve
DownloadsMolfile
FormulaC26H48NO7P
Net Charge0
Average Mass517.644
Monoisotopic Mass517.31684
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCC[N+](C)(C)C
InChIInChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3/b7-6-,10-9-,13-12-/t25-/m1/s1
InChIKeyWKQNRCYKYCKESD-YVHLTTHBSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-α-linolenoyl-sn-glycero-3-phosphocholine (CHEBI:133456) is a lysophosphatidylcholine (18:3/0:0) (CHEBI:131741)
1-α-linolenoyl-sn-glycero-3-phosphocholine (CHEBI:133456) is a α-linolenoyl-sn-glycero-3-phosphocholine (CHEBI:140445)
IUPAC Name 
(2R)-2-hydroxy-3-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms  Source
1-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholineChEBI
1-linolenoyl-sn-glycero-3-phosphocholineChEBI
1-[(9Z,12Z,15Z)-octadec-9,12,15-trienoyl]-sn-glycero-3-phosphocholineChEBI
PC(18:3)ChEBI
GPC(18:3)ChEBI
PC(18:3/0:0)ChEBI
UniProt Name  Source
1-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocholineUniProt
Manual XrefsDatabases
LMGP01050038LIPID MAPS
HMDB0010388HMDB
CPD-8348MetaCyc
Registry NumbersSources
Reaxys:5666717Reaxys