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CHEBI:176726 - 1-octadecanoyl-2-eicosanoyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:176726
ChEBI Name1-octadecanoyl-2-eicosanoyl-sn-glycero-3-phosphoethanolamine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H86NO8P
Net Charge0
Average Mass776.134
Monoisotopic Mass775.60911
SMILESCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C43H86NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h41H,3-40,44H2,1-2H3,(H,47,48)/t41-/m1/s1
InChIKeyTZINTCMFTOUPSN-VQJSHJPSSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
blood plasma (BTO:0000118) MetaboLights (MTBLS2262)
ChEBI Ontology
Outgoing Relation(s)
1-octadecanoyl-2-eicosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:176726) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-octadecanoyloxypropan-2-yl] icosanoate
Manual XrefsDatabases
HMDB0008998HMDB
395644ChemSpider
LMGP02010069LIPID MAPS