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CHEBI:134077 - 1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine

Default Structure
ChEBI IDCHEBI:134077
ChEBI Name1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine
DefinitionA 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the 1- and 2-acyl groups are specified as tetradecanoyl and docosanoyl respectively.
Last Modified17 May 2017
SubmitterKeeva
DownloadsMolfile
FormulaC41H82NO8P
Net Charge0
Average Mass748.080
Monoisotopic Mass747.57781
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C41H82NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42)37-47-40(43)33-31-29-27-25-23-14-12-10-8-6-4-2/h39H,3-38,42H2,1-2H3,(H,45,46)/t39-/m1/s1
InChIKeyRUGZHLOPROZNNS-LDLOPFEMSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS313)
Rattus norvegicus (ncbitaxon:10116) - MetaboLights (MTBLS313)
Roles Classification
Biological Roles:
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:134077) has functional parent docosanoic acid (CHEBI:28941)
1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:134077) has functional parent tetradecanoic acid (CHEBI:28875)
1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:134077) has role mouse metabolite (CHEBI:75771)
1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:134077) has role rat metabolite (CHEBI:86264)
1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:134077) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
1-tetradecanoyl-2-docosanoyl-sn-glycero-3-phosphoethanolamine (CHEBI:134077) is a phosphatidylethanolamine 36:0 (CHEBI:134435)
IUPAC Name 
(17R)-23-amino-20-hydroxy-14,20-dioxo-15,19,21-trioxa-20λ5-phosphatricosan-17-yl docosanoate
Synonyms  Source
1-myristoyl-2-behenoyl-sn-glycero-3-phosphoethanolamineChEBI
PE(14:0/22:0)HMDB
PE(36:0)ChEBI
phosphatidylethanolamine(14:0/22:0)ChEBI
phosphatidylethanolamine(36:0)ChEBI
Manual XrefsDatabases
HMDB0008841HMDB