EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:85797 - N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine

ChEBI IDCHEBI:85797
ChEBI NameN-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine
Stars
ASCII NameN-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine
DefinitionAn N-acylphosphatidylethanolamine in which the N-acyl group is specified as capryloyl (octanoyl) while the phosphatidyl acyl groups at position 1 and 2 are specified as palmitoyl (hexadecanoyl) and linoleoyl (9Z,12Z-octadecadienoyl) respectively.
Last Modified20 May 2015
SubmitterSteve
DownloadsMolfile
FormulaC47H88NO9P
Net Charge0
Average Mass842.193
Monoisotopic Mass841.61967
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCCNC(=O)CCCCCCC
InChIInChI=1S/C47H88NO9P/c1-4-7-10-13-15-17-19-21-22-24-26-28-30-33-36-39-47(51)57-44(43-56-58(52,53)55-41-40-48-45(49)37-34-31-12-9-6-3)42-54-46(50)38-35-32-29-27-25-23-20-18-16-14-11-8-5-2/h15,17,21-22,44H,4-14,16,18-20,23-43H2,1-3H3,(H,48,49)(H,52,53)/b17-15-,22-21-/t44-/m1/s1
InChIKeyCWPRYKPQPOWVHW-CKEWFYKPSA-N
ChEBI Ontology
Outgoing Relation(s)
N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85797) has functional parent hexadecanoic acid (CHEBI:15756)
N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85797) has functional parent linoleic acid (CHEBI:17351)
N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85797) has functional parent octanoic acid (CHEBI:28837)
N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85797) is a N-acylphosphatidylethanolamine (CHEBI:61232)
N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85797) is conjugate acid of N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85296)
Incoming Relation(s)
N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine(1−) (CHEBI:85296) is conjugate base of N-capryloyl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85797)
Synonyms  Source
N-octanoyl-1-hexadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoethanolamineChEBI
(16R)-13-hydroxy-8,13,19-trioxo-12,14,18-trioxa-9-aza-13λ5-phosphatetratriacontan-16-yl (9Z,12Z)-octadeca-9,12-dienoateChEBI