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CHEBI:187220 - PS(O-18:0/17:2(9Z,12Z))

ChEBI IDCHEBI:187220
ChEBI NamePS(O-18:0/17:2(9Z,12Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H78NO9P
Net Charge0
Average Mass760.047
Monoisotopic Mass759.54142
SMILESCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C41H78NO9P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-48-35-38(36-49-52(46,47)50-37-39(42)41(44)45)51-40(43)33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h10,12,16,18,38-39H,3-9,11,13-15,17,19-37,42H2,1-2H3,(H,44,45)(H,46,47)/b12-10-,18-16-/t38-,39+/m1/s1
InChIKeyQNIOWDJBEDFQPG-VXMPBLKKSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
PS(O-18:0/17:2(9Z,12Z)) (CHEBI:187220) is a ether lipid (CHEBI:64611)
PS(O-18:0/17:2(9Z,12Z)) (CHEBI:187220) is a glycerophosphoserine (CHEBI:35766)
IUPAC Name 
(2S)-2-amino-3-[[(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-octadecoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376592ChemSpider
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