CHEBI:89516 - PC(14:0/22:1(13Z))

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ChEBI Name PC(14:0/22:1(13Z))
ChEBI ID CHEBI:89516
Stars This entity has been manually annotated by a third party.
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Formula C44H86NO8P
Net Charge 0
Average Mass 788.131
Monoisotopic Mass 787.60911
InChI InChI=1S/C44H86NO8P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h19-20,42H,6-18,21-41H2,1-5H3/b20-19-/t42-/m1/s1
InChIKey LOVKBDFNFACEND-HSEDGGQWSA-N
SMILES C([C@@](COC(CCCCCCCCCCCCC)=O)(OC(CCCCCCCCCCC/C=C\CCCCCCCC)=O)[H])OP([O-])(=O)OCC[N+](C)(C)C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: Dame, ZT. et al. (2014) The Human Saliva Metabolome (manuscript in preparation)
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
ChEBI Ontology
Outgoing PC(14:0/22:1(13Z)) (CHEBI:89516) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
Synonyms Sources
(2-{[(2R)-2-[(13Z)-docos-13-enoyloxy]-3-(tetradecanoyloxy)propyl phosphonato]oxy}ethyl)trimethylazanium HMDB
1-Myristoyl-2-erucoyl-sn-glycero-3-phosphocholine HMDB
GPCho(14:0/22:1) HMDB
GPCho(14:0/22:1n9) HMDB
GPCho(14:0/22:1w9) HMDB
GPCho(36:1) HMDB
Lecithin HMDB
PC aa C36:1 HMDB
PC(14:0/22:1) HMDB
PC(14:0/22:1n9) HMDB
PC(14:0/22:1w9) HMDB
PC(36:1) HMDB
Phosphatidylcholine(14:0/22:1) HMDB
Phosphatidylcholine(14:0/22:1n9) HMDB
Phosphatidylcholine(14:0/22:1w9) HMDB
Phosphatidylcholine(36:1) HMDB
Manual Xrefs Databases
HMDB0007887 HMDB
Lecithin Wikipedia
PHOSPHATIDYLCHOLINE MetaCyc
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Citation Waiting for Citations Type Source
24023812 PubMed citation Europe PMC