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CHEBI:133675 - 1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion

ChEBI IDCHEBI:133675
ChEBI Name1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion
Stars
ASCII Name1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion
DefinitionA 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion in which the alkenyl and acyl groups are specified as (1Z)-octadecenyl and linoleoyl respectively.
Last Modified7 October 2016
SubmitterSteve
DownloadsMolfile
FormulaC41H78NO7P
Net Charge0
Average Mass728.049
Monoisotopic Mass727.55159
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](CO/C=C\CCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[NH3+]
InChIInChI=1S/C41H78NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-46-38-40(39-48-50(44,45)47-37-35-42)49-41(43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,33,36,40H,3-11,13,15-17,19,21-32,34-35,37-39,42H2,1-2H3,(H,44,45)/b14-12-,20-18-,36-33-/t40-/m1/s1
InChIKeyXVXISDREVDGQPX-PISDLAQISA-N
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133675) has role mouse metabolite (CHEBI:75771)
1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133675) is a 1-(Z)-alk-1-enyl-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:77290)
1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133675) is a 1-O-(1Z-octadecenyl)-2-acyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:145182)
1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133675) is tautomer of 1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:90483)
Incoming Relation(s)
1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:90483) is tautomer of 1-(1Z-octadecenyl)-2-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133675)
IUPAC Name 
2-azaniumylethyl (2R)-2-{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}-3-{[(1Z)-octadec-1-en-1-yl]oxy}propyl phosphate
Synonyms  Source
PE(P-18:0/18:2(9Z,12Z))ChEBI
1-(1Z-octadecenyl)-2-(9Z,12Z-octadecadienoyl)-glycero-3-phosphoethanolamine zwitterionChEBI
GPE(P-18:0/18:2)ChEBI
1-(1-enyl-stearoyl)-2-linoleoyl-GPEChEBI
1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)ChEBI