{ "iri" : "http://purl.obolibrary.org/obo/CHEBI_90579", "lang" : "en", "description" : [ "A lysophosphatidylethanolamine 20:3 in which the acyl group is specified as (5Z,8Z,11Z)-icosatrienoyl and is located at position 2." ], "synonyms" : [ "(2R)-1-{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxypropan-2-yl (5Z,8Z,11Z)-icosa-5,8,11-trienoate", "(5Z,8Z,11Z-Eicosatrienoyl)-lysophosphatidylethanolamine", "2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphoethanolamine", "LPE(0:0/20:3)", "LPE(0:0/20:3n9)", "LPE(0:0/20:3w9)", "LPE(20:3)", "LysoPE(0:0/20:3(5Z,8Z,11Z))", "LysoPE(0:0/20:3)", "LysoPE(0:0/20:3n9)", "LysoPE(0:0/20:3w9)", "LysoPE(20:3)", "Lysophosphatidylethanolamine(0:0/20:3)", "Lysophosphatidylethanolamine(0:0/20:3n9)", "Lysophosphatidylethanolamine(0:0/20:3w9)", "Lysophosphatidylethanolamine(20:3)", "lyso-PE(0:0/20:3)", "lyso-PE(0:0/20:3n9)", "lyso-PE(0:0/20:3w9)", "lyso-PE(20:3)" ], "annotation" : { "charge" : [ "0" ], "formula" : [ "C25H46NO7P" ], "has_dbxref" : [ "Chemspider:24769366", "HMDB:HMDB0011485", "PMID:25114169", "PMID:27471436" ], "has_obo_namespace" : [ "chebi_ontology" ], "id" : [ "CHEBI:90579" ], "inchi" : [ "InChI=1S/C25H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)33-24(22-27)23-32-34(29,30)31-21-20-26/h9-10,12-13,15-16,24,27H,2-8,11,14,17-23,26H2,1H3,(H,29,30)/b10-9-,13-12-,16-15-/t24-/m1/s1" ], "inchikey" : [ "FJDVENKXPUIXRG-WMTBOZPISA-N" ], "mass" : [ "503.610" ], "monoisotopicmass" : [ "503.30119" ], "smiles" : [ "C([C@@H](CO)OC(CCC/C=C\\C/C=C\\C/C=C\\CCCCCCCC)=O)OP(=O)(OCCN)O" ] }, "label" : "2-[(5Z,8Z,11Z)-icosatrienoyl]-sn-glycero-3-phosphoethanolamine", "ontology_name" : "chebi", "ontology_prefix" : "CHEBI", "ontology_iri" : "http://purl.obolibrary.org/obo/chebi.owl", "is_obsolete" : false, "term_replaced_by" : null, "is_defining_ontology" : true, "has_children" : false, "is_root" : false, "short_form" : "CHEBI_90579", "obo_id" : "CHEBI:90579", "in_subset" : [ "3_STAR" ], "obo_definition_citation" : null, "obo_xref" : [ { "database" : "Chemspider", "id" : "24769366", "description" : null, "url" : "http://www.chemspider.com/Chemical-Structure.24769366.html" }, { "database" : "HMDB", "id" : "HMDB0011485", "description" : null, "url" : "http://www.hmdb.ca/metabolites/HMDB0011485" }, { "database" : "PMID", "id" : "25114169", "description" : "Europe PMC", "url" : "http://www.ncbi.nlm.nih.gov/pubmed/25114169" }, { "database" : "PMID", "id" : "27471436", "description" : "Europe PMC", "url" : "http://www.ncbi.nlm.nih.gov/pubmed/27471436" } ], "obo_synonym" : [ { "name" : "(2R)-1-{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-3-hydroxypropan-2-yl (5Z,8Z,11Z)-icosa-5,8,11-trienoate", "scope" : "hasExactSynonym", "type" : "IUPAC NAME", "xrefs" : [ { "database" : null, "id" : "IUPAC", "description" : null, "url" : null } ] }, { "name" : "(5Z,8Z,11Z-Eicosatrienoyl)-lysophosphatidylethanolamine", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "2-[(5Z,8Z,11Z)-eicosatrienoyl]-sn-glycero-3-phosphoethanolamine", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "ChEBI", "description" : null, "url" : null } ] }, { "name" : "LPE(0:0/20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LPE(0:0/20:3n9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LPE(0:0/20:3w9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LPE(20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LysoPE(0:0/20:3(5Z,8Z,11Z))", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "ChEBI", "description" : null, "url" : null } ] }, { "name" : "LysoPE(0:0/20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LysoPE(0:0/20:3n9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LysoPE(0:0/20:3w9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "LysoPE(20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "Lysophosphatidylethanolamine(0:0/20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "Lysophosphatidylethanolamine(0:0/20:3n9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "Lysophosphatidylethanolamine(0:0/20:3w9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "Lysophosphatidylethanolamine(20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "lyso-PE(0:0/20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "lyso-PE(0:0/20:3n9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "lyso-PE(0:0/20:3w9)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] }, { "name" : "lyso-PE(20:3)", "scope" : "hasRelatedSynonym", "type" : null, "xrefs" : [ { "database" : null, "id" : "HMDB", "description" : null, "url" : null } ] } ], "is_preferred_root" : false, "_links" : { "self" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579?lang=en" }, "parents" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/parents" }, "ancestors" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/ancestors" }, "hierarchicalParents" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/hierarchicalParents" }, "hierarchicalAncestors" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/hierarchicalAncestors" }, "jstree" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/jstree" }, "graph" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/graph" }, "has_functional_parent" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252Fchebi%2523has_functional_parent" }, "has_role" : { "href" : "https://www.ebi.ac.uk/ols4/api/ontologies/chebi/terms/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FCHEBI_90579/http%253A%252F%252Fpurl.obolibrary.org%252Fobo%252FRO_0000087" } } }