CHEBI:131663 - 1,2-bis-[(9Z,11Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1,2-bis-[(9Z,11Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine ChEBI ID CHEBI:131663 ChEBI ASCII Name 1,2-bis-[(9Z,11Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine Definition A 1,2-diacyl-sn-glycero-3-phosphoethanolamine in which the acyl groups at positions 1 and 2 are both specified as (9Z,11Z)-octadecadienoyl. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C41H74NO8P Net Charge 0 Average Mass 740.003 Monoisotopic Mass 739.51521 InChI InChI=1S/C41H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-20,39H,3-12,21-38,42H2,1-2H3,(H,45,46)/b15-13-,16-14-,19-17-,20-18-/t39-/m1/s1 InChIKey CMCPQFKZYMRAKT-UHSBSJHCSA-N SMILES O(C(=O)CCCCCCC/C=C\C=C/CCCCCC)C[C@H](COP(=O)(OCCN)O)OC(=O)CCCCCCC/C=C\C=C/CCCCCC Metabolite of Species Details Mus musculus (NCBI:txid10090) See: PubMed Mus musculus (NCBI:txid10090) See: MetaboLights Study Roles Classification Biological Role(s): mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). View more via ChEBI Ontology ChEBI Ontology Outgoing 1,2-bis-[(9Z,11Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine (CHEBI:131663) has functional parent octadeca-9,11-dienoic acid (CHEBI:36025) 1,2-bis-[(9Z,11Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine (CHEBI:131663) has role mouse metabolite (CHEBI:75771) 1,2-bis-[(9Z,11Z)-octadecadienoyl]-sn-glycero-3-phosphoethanolamine (CHEBI:131663) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674) IUPAC Name 3-{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[(9Z,11Z)-octadeca-9,11-dienoyl]oxy}propyl (9Z,11Z)-octadeca-9,11-dienoate Synonym Source PE(18:2(9Z,11Z)/18:2(9Z,11Z)) ChEBI Manual Xref Database 7825686 ChemSpider View more database links Citation Type Source 27471436 PubMed citation Europe PMC Last Modified 16 November 2016