CHEBI:139560 - 2-[(9Z)-12-hydroxyoctadec-9-enoyl]-sn-glycero-3-phosphocholine

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ChEBI Name 2-[(9Z)-12-hydroxyoctadec-9-enoyl]-sn-glycero-3-phosphocholine
ChEBI ID CHEBI:139560
ChEBI ASCII Name 2-[(9Z)-12-hydroxyoctadec-9-enoyl]-sn-glycero-3-phosphocholine
Definition A 2-acyl-sn-glycero-3-phosphocholine in which the acyl group is specified as (9Z)-12-hydroxyoctadec-9-enoyl.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter AnneNiknejad
Supplier Information
Download Molfile XML SDF
Formula C26H52NO8P
Net Charge 0
Average Mass 537.668
Monoisotopic Mass 537.34305
InChI InChI=1S/C26H52NO8P/c1-5-6-7-14-17-24(29)18-15-12-10-8-9-11-13-16-19-26(30)35-25(22-28)23-34-36(31,32)33-21-20-27(2,3)4/h12,15,24-25,28-29H,5-11,13-14,16-23H2,1-4H3/b15-12-/t24?,25-/m1/s1
InChIKey NWKGPTOQIOBTPZ-QOPIDNHZSA-N
SMILES P(OC[C@@H](CO)OC(CCCCCCC/C=C\CC(CCCCCC)O)=O)(=O)(OCC[N+](C)(C)C)[O-]
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via lysophosphatidylcholine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-[(9Z)-12-hydroxyoctadec-9-enoyl]-sn-glycero-3-phosphocholine (CHEBI:139560) has functional parent (9Z)-12-hydroxyoctadec-9-enoic acid (CHEBI:85639)
2-[(9Z)-12-hydroxyoctadec-9-enoyl]-sn-glycero-3-phosphocholine (CHEBI:139560) is a 2-acyl-sn-glycero-3-phosphocholine (CHEBI:57875)
2-[(9Z)-12-hydroxyoctadec-9-enoyl]-sn-glycero-3-phosphocholine (CHEBI:139560) is a ricinoleoyl-sn-glycero-3-phosphocholine (CHEBI:140446)
IUPAC Name
(2R)-3-hydroxy-2-{[(9Z)-12-hydroxyoctadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
Synonyms Sources
2-(12-hydroxy-9Z-octadecenoyl)-sn-glycero-3-phosphocholine UniProt
2-(12-hydroxyoleoyl)-sn-glycero-3-phosphocholine ChEBI
Citation Waiting for Citations Type Source
1747126 PubMed citation SUBMITTER
Last Modified
19 March 2018