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CHEBI:168421 - LysoPE(0:0/15:0)

ChEBI IDCHEBI:168421
ChEBI NameLysoPE(0:0/15:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H42NO7P
Net Charge0
Average Mass439.530
Monoisotopic Mass439.26989
SMILESCCCCCCCCCCCCCCC(=O)O[C@H](CO)COP(=O)(O)OCCN
InChIInChI=1S/C20H42NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20(23)28-19(17-22)18-27-29(24,25)26-16-15-21/h19,22H,2-18,21H2,1H3,(H,24,25)/t19-/m1/s1
InChIKeyGIUNBNKDUHWVHI-LJQANCHMSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
LysoPE(0:0/15:0) (CHEBI:168421) is a 2-acyl-sn-glycero-3-phosphoethanolamine (CHEBI:28936)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-hydroxypropan-2-yl] pentadecanoate
Manual XrefsDatabases
LMGP02050035LIPID MAPS
24769353ChemSpider
HMDB0011472HMDB