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CHEBI:133140 - 1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:133140
ChEBI Name1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine
Stars
ASCII Name1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine
Definition1-(alk-1-enyl)-sn-glycero-3-phosphoethanolamine in which the alk-1-enyl group is specified as (E)-hexadec-1-enyl.
Last Modified25 August 2016
SubmitterSteve
DownloadsMolfile
FormulaC21H44NO6P
Net Charge0
Average Mass437.558
Monoisotopic Mass437.29062
SMILESCCCCCCCCCCCCCC/C=C/OC[C@@H](O)COP(=O)(O)OCCN
InChIInChI=1S/C21H44NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-26-19-21(23)20-28-29(24,25)27-18-16-22/h15,17,21,23H,2-14,16,18-20,22H2,1H3,(H,24,25)/b17-15+/t21-/m1/s1
InChIKeyQYTPGOPLNFESQC-RLHAVTDZSA-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-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine (CHEBI:133140) is a 1-(alk-1-enyl)-sn-glycero-3-phosphoethanolamine (CHEBI:15785)
1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine (CHEBI:133140) is tautomer of 1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133139)
Incoming Relation(s)
1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine zwitterion (CHEBI:133139) is tautomer of 1-[(E)-hexadec-1-enyl]-sn-glycero-3-phosphoethanolamine (CHEBI:133140)
IUPAC Name 
2-aminoethyl (2R)-3-{[(1E)-hexadec-1-en-1-yl]oxy}-2-hydroxypropyl hydrogen phosphate
Synonyms  Source
GPE(P-16:0/0:0)ChEBI
PE(P-16:0)ChEBI
GPE(P-16:0(1E)/0:0)ChEBI
phosphoethanolamine (P-16:0)ChEBI
phosphoethanolamine (P-16:0/0:0)ChEBI
PE(P-16:0/0:0)ChEBI