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1-hexadecanoyl-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine zwitterion

Go to external page http://purl.obolibrary.org/obo/CHEBI_133656

A phosphatidylethanolamine 36:3 zwitterion in which the 1- and 2-acyl groups are specified as hexadecanoyl (palmitoyl) and (8Z,11Z,14Z)-icosatrienoyl respectively.

Term info

Label

1-hexadecanoyl-2-(8Z,11Z,14Z-icosatrienoyl)-sn-glycero-3-phosphoethanolamine zwitterion

Synonyms
  • 2-azaniumylethyl (2R)-3-(hexadecanoyloxy)-2-{[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxy}propyl phosphate
Subsets

3_STAR

IUPAC NAME
2-azaniumylethyl (2R)-3-(hexadecanoyloxy)-2-{[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxy}propyl phosphate [ IUPAC ]

charge

0

formula

C41H76NO8P

has obo namespace

chebi_ontology

has related synonym

GPE(16:0/20:3), 1-hexadecanoyl-2-[(8Z,11Z,14Z)-icosatrienoyl]-sn-glycero-3-phosphoethanolamine zwitterion, PE(16:0/20:3), 1-palmitoyl-2-dihomolinolenoyl-GPE (16:0/20:3), 1-hexadecanoyl-2-[(8Z,11Z,14Z)-eicosatrienoyl]-sn-glycero-3-phosphoethanolamine zwitterion, 1-palmitoyl-2-dihomolinolenoyl-GPE

id

CHEBI:133656

inchi

InChI=1S/C41H76NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(44)50-39(38-49-51(45,46)48-36-35-42)37-47-40(43)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h11,13,17-18,20,22,39H,3-10,12,14-16,19,21,23-38,42H2,1-2H3,(H,45,46)/b13-11-,18-17-,22-20-/t39-/m1/s1

inchikey

LMWFNZUKABEGHS-CISNCOODSA-N

mass

742.019

monoisotopicmass

741.53086

smiles

P(OC[C@@H](COC(CCCCCCCCCCCCCCC)=O)OC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O)(=O)(OCC[NH3+])[O-]