CHEBI:77833 - 1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:77833
ChEBI ASCII Name 1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine
Definition A 1,2-diacyl-sn-glycero-3-phosphocholine in which the two acyl substituents at positions 1 and 2 are specified as palmitoyl and valeroyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
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Formula C29H58NO8P
Net Charge 0
Average Mass 579.74650
Monoisotopic Mass 579.39000
InChI InChI=1S/C29H58NO8P/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-22-28(31)35-25-27(38-29(32)21-9-7-2)26-37-39(33,34)36-24-23-30(3,4)5/h27H,6-26H2,1-5H3/t27-/m1/s1
InChIKey GJOJUVBYCFSGJT-HHHXNRCGSA-N
SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCC
ChEBI Ontology
Outgoing 1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine (CHEBI:77833) has functional parent hexadecanoic acid (CHEBI:15756)
1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine (CHEBI:77833) has functional parent valeric acid (CHEBI:17418)
1-palmitoyl-2-valeroyl-sn-glycero-3-phosphocholine (CHEBI:77833) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name
(2R)-3-(hexadecanoyloxy)-2-(pentanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
(2R)-3-(palmitoyloxy)-2-(pentanoyloxy)propyl 2-(trimethylammonio)ethyl phosphate IUPAC
1-hexadecanoyl-2-pentanoyl-sn-glycero-3-phosphocholine UniProt
PC(16:0/5:0) LIPID MAPS
Manual Xref Database
LMGP01010672 LIPID MAPS
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Registry Number Type Source
4045295 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
2040620 PubMed citation SUBMITTER
Last Modified
06 February 2015