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CHEBI:189610 - PE(37:5)

ChEBI IDCHEBI:189610
ChEBI NamePE(37:5)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H74NO8P
Net Charge0
Average Mass752.027
Monoisotopic Mass751.51520
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\CCCCC
InChIInChI=1S/C42H74NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43)51-42(45)35-33-31-29-27-24-16-14-12-10-8-6-4-2/h11-14,17-18,20-21,23,25,40H,3-10,15-16,19,22,24,26-39,43H2,1-2H3,(H,46,47)/b13-11-,14-12-,18-17-,21-20-,25-23-/t40-/m1/s1
InChIKeyKNOOTSNCDVJBRP-DUDWQIJOSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
heart (BTO:0000562) MetaboLights (MTBLS1887)
serum (BTO:0000133) MetaboLights (MTBLS1887)
liver (BTO:0000759) MetaboLights (MTBLS1887)
ChEBI Ontology
Outgoing Relation(s)
PE(37:5) (CHEBI:189610) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-pentadec-9-enoyl]oxypropyl] (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate
Manual XrefsDatabases
113375837ChemSpider
LMGP02011107LIPID MAPS