CHEBI:86109 - 1-octadecanoyl-2-[(11Z)-octadecenoyl]-sn-glycerophosphochlonine

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ChEBI Name 1-octadecanoyl-2-[(11Z)-octadecenoyl]-sn-glycerophosphochlonine
ChEBI ID CHEBI:86109
ChEBI ASCII Name 1-octadecanoyl-2-[(11Z)-octadecenoyl]-sn-glycerophosphochlonine
Definition A 1-octadecanoyl-2-octadecenoyl-sn-glycero-3-phosphocholine in which the acyl groups specified at positions 1 and 2 are octadecanoyl and (11Z)-octadecenoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C44H86NO8P
Net Charge 0
Average Mass 788.12930
Monoisotopic Mass 787.60911
InChI InChI=1S/C44H86NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h17,19,42H,6-16,18,20-41H2,1-5H3/b19-17-/t42-/m1/s1
InChIKey AEAMHDRXCYEOCU-HTDYWKJCSA-N
SMILES CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCC\C=C/CCCCCC
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via 1-octadecanoyl-2-octadecenoyl-sn-glycero-3-phosphocholine )
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via phosphatidylcholine 36:1 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-octadecanoyl-2-[(11Z)-octadecenoyl]-sn-glycerophosphochlonine (CHEBI:86109) has functional parent cis-vaccenic acid (CHEBI:50464)
1-octadecanoyl-2-[(11Z)-octadecenoyl]-sn-glycerophosphochlonine (CHEBI:86109) is a 1-octadecanoyl-2-octadecenoyl-sn-glycero-3-phosphocholine (CHEBI:84818)
IUPAC Name
(2R)-3-(octadecanoyloxy)-2-{[(11Z)-octadec-11-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-Stearoyl-2-vaccenoyl-sn-glycero-3-phosphocholine HMDB
GPCho(18:0/18:1) HMDB
GPCho(18:0/18:1n7) HMDB
GPCho(18:0/18:1w7) HMDB
PC(18:0/18:1) HMDB
PC(18:0/18:1n7) HMDB
PC(18:0/18:1w7) HMDB
Manual Xrefs Databases
HMDB0008037 HMDB
LMGP01010750 LIPID MAPS
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Last Modified
23 October 2015