CHEBI:138214 - 1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine

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ChEBI Name 1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:138214
ChEBI ASCII Name 1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine
Definition A phosphatidylcholine 27:0 in which the acyl groups at positions 1 and 2 are specified as octadecanoyl and nonanoyl respectively.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
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Formula C35H70NO8P
Net Charge 0
Average Mass 663.907
Monoisotopic Mass 663.48391
InChI InChI=1S/C35H70NO8P/c1-6-8-10-12-14-15-16-17-18-19-20-21-22-24-25-27-34(37)41-31-33(44-35(38)28-26-23-13-11-9-7-2)32-43-45(39,40)42-30-29-36(3,4)5/h33H,6-32H2,1-5H3/t33-/m1/s1
InChIKey CLUNFPZKGTYNMF-MGBGTMOVSA-N
SMILES P(OC[C@@H](COC(CCCCCCCCCCCCCCCCC)=O)OC(=O)CCCCCCCC)(=O)(OCC[N+](C)(C)C)[O-]
ChEBI Ontology
Outgoing 1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine (CHEBI:138214) has functional parent nonanoic acid (CHEBI:29019)
1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine (CHEBI:138214) has functional parent octadecanoic acid (CHEBI:28842)
1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine (CHEBI:138214) is a phosphatidylcholine 27:0 (CHEBI:137595)
IUPAC Name
(2R)-2-(nonanoyloxy)-3-(octadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
1-octadecanoyl-2-nonanoyl-sn-glycero-3-phosphocholine UniProt
1-stearoyl-2-nonanoyl-sn-glycero-3-phosphocholine zwitterion ChEBI
PC(18:0/9:0) SUBMITTER
phosphatidylcholine 18:0/9:0 ChEBI
Citation Waiting for Citations Type Source
21926997 PubMed citation SUBMITTER
Last Modified
02 November 2017