CHEBI:85791 - N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine
ChEBI ID CHEBI:85791
ChEBI ASCII Name N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine
Definition An N-acylphosphatidylethanolamine in which the N-acyl group is specified as stearoyl (octadecanoyl) while the phosphatidyl acyl groups are both specified as oleoyl (9Z-octadecenoyl).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C59H112NO9P
Net Charge 0
Average Mass 1010.49560
Monoisotopic Mass 1009.80747
InChI InChI=1S/C59H112NO9P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-57(61)60-52-53-67-70(64,65)68-55-56(69-59(63)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)54-66-58(62)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h26-27,29-30,56H,4-25,28,31-55H2,1-3H3,(H,60,61)(H,64,65)/b29-26-,30-27-/t56-/m1/s1
InChIKey GNAPJEPSPJZGSJ-WJOAKYJCSA-N
SMILES CCCCCCCCCCCCCCCCCC(=O)NCCOP(O)(=O)OC[C@@H](COC(=O)CCCCCCC\C=C/CCCCCCCC)OC(=O)CCCCCCC\C=C/CCCCCCCC
ChEBI Ontology
Outgoing N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) has functional parent octadecanoic acid (CHEBI:28842)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) has functional parent oleic acid (CHEBI:16196)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) is a N-acylphosphatidylethanolamine (CHEBI:61232)
N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791) is conjugate acid of N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85292)
Incoming N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85292) is conjugate base of N-stearoyl-1,2-dioleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85791)
IUPAC Name
(2R)-5-hydroxy-2-{[(9Z)-octadec-9-enoyl]oxy}-5,10-dioxo-4,6-dioxa-9-aza-5λ5-phosphaheptacosan-1-yl (9Z)-octadec-9-enoate
Synonym Source
N-octadecanoyl-1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine ChEBI
Last Modified
19 May 2015