CHEBI:131658 - 1-[(9Z)-hexadecenyl]-2-acetyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-[(9Z)-hexadecenyl]-2-acetyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:131658
ChEBI ASCII Name 1-[(9Z)-hexadecenyl]-2-acetyl-sn-glycero-3-phosphocholine
Definition A 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine in which the alkyl group is specified as (9Z)-hexadecenyl.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H52NO7P
Net Charge 0
Average Mass 521.668
Monoisotopic Mass 521.34814
InChI InChI=1S/C26H52NO7P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-31-23-26(34-25(2)28)24-33-35(29,30)32-22-20-27(3,4)5/h11-12,26H,6-10,13-24H2,1-5H3/b12-11-/t26-/m1/s1
InChIKey UURHYSSHOYMCKH-XCMWCYMESA-N
SMILES C(C[N+](C)(C)C)OP(=O)([O-])OC[C@H](OC(=O)C)COCCCCCCCC/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-[(9Z)-hexadecenyl]-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:131658) has role mouse metabolite (CHEBI:75771)
1-[(9Z)-hexadecenyl]-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:131658) is a 2-acetyl-1-alkyl-sn-glycero-3-phosphocholine (CHEBI:36707)
IUPAC Name
(2R)-2-(acetyloxy)-3-{[(9Z)-hexadec-9-en-1-yl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
PC(O-16:1(9Z)/2:0) ChEBI
phosphatidylcholine (O-16:1(9Z)/2:0) ChEBI
Citation Waiting for Citations Type Source
27471436 PubMed citation Europe PMC
Last Modified
15 November 2016