CHEBI:131659 - 1-[(9Z)-hexadecenoyl]-2-acetyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-[(9Z)-hexadecenoyl]-2-acetyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:131659
ChEBI ASCII Name 1-[(9Z)-hexadecenoyl]-2-acetyl-sn-glycero-3-phosphocholine
Definition A 1,2-diacyl-sn-glycero-3-phosphocholine in which the acyl groups at positions 1 and 2 are specified as (9Z)-hexadecenoyl and acetyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H50NO8P
Net Charge 0
Average Mass 535.652
Monoisotopic Mass 535.32740
InChI InChI=1S/C26H50NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)32-22-25(35-24(2)28)23-34-36(30,31)33-21-20-27(3,4)5/h11-12,25H,6-10,13-23H2,1-5H3/b12-11-/t25-/m1/s1
InChIKey QALLXIUHRUVULB-OKFWSBNLSA-N
SMILES C(C[N+](C)(C)C)OP(=O)([O-])OC[C@H](OC(=O)C)COC(CCCCCCC/C=C\CCCCCC)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Mus musculus (NCBI:txid10090) See: PubMed
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)-hexadecenoyl]-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:131659) has functional parent palmitoleic acid (CHEBI:28716)
1-[(9Z)-hexadecenoyl]-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:131659) has role mouse metabolite (CHEBI:75771)
1-[(9Z)-hexadecenoyl]-2-acetyl-sn-glycero-3-phosphocholine (CHEBI:131659) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name
(2R)-2-(acetyloxy)-3-{[(9Z)-hexadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-(9Z-hexadecenoyl)-2-acetyl-sn-glycero-3-phosphocholine LIPID MAPS
1-palmitoleoyl-2-acetyl-sn-glycero-3-phosphocholine ChEBI
PC(16:1(9Z)/2:0) ChEBI
PC(16:1/2:0) LIPID MAPS
phosphatidylcholine (16:1(9Z)/2:0) ChEBI
phosphatidylcholine (16:1/2:0) ChEBI
Manual Xref Database
LMGP01010693 LIPID MAPS
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Registry Number Type Source
30084827 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
27471436 PubMed citation Europe PMC
Last Modified
15 November 2016