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CHEBI:188111 - PS(O-18:0/18:2(9Z,12Z))

ChEBI IDCHEBI:188111
ChEBI NamePS(O-18:0/18:2(9Z,12Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H80NO9P
Net Charge0
Average Mass774.074
Monoisotopic Mass773.55707
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C42H80NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-49-36-39(37-50-53(47,48)51-38-40(43)42(45)46)52-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,39-40H,3-11,13,15-17,19,21-38,43H2,1-2H3,(H,45,46)(H,47,48)/b14-12-,20-18-/t39-,40+/m1/s1
InChIKeyWXRCHXMWBCRFEC-XUJMPRFSSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
PS(O-18:0/18:2(9Z,12Z)) (CHEBI:188111) is a ether lipid (CHEBI:64611)
PS(O-18:0/18:2(9Z,12Z)) (CHEBI:188111) is a glycerophosphoserine (CHEBI:35766)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-octadecoxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376594ChemSpider
LMGP03020028LIPID MAPS