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CHEBI:189564 - PS(P-18:0/12:0)

ChEBI IDCHEBI:189564
ChEBI NamePS(P-18:0/12:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H70NO9P
Net Charge0
Average Mass691.928
Monoisotopic Mass691.47882
SMILESCCCCCCCCCCCCCCCC/C=C\OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCCCCCC
InChIInChI=1S/C36H70NO9P/c1-3-5-7-9-11-13-14-15-16-17-18-19-21-23-25-27-29-43-30-33(31-44-47(41,42)45-32-34(37)36(39)40)46-35(38)28-26-24-22-20-12-10-8-6-4-2/h27,29,33-34H,3-26,28,30-32,37H2,1-2H3,(H,39,40)(H,41,42)/b29-27-/t33-,34+/m1/s1
InChIKeyYHFQOJAJZJQFEQ-MHBUEFIPSA-N
Species of MetaboliteComponentSourceComments
Klebsiella pneumoniae (ncbitaxon:573) Whole Organism (NCIT:C13413) MetaboLights (MTBLS4132)
ChEBI Ontology
Outgoing Relation(s)
PS(P-18:0/12:0) (CHEBI:189564) is a ether lipid (CHEBI:64611)
PS(P-18:0/12:0) (CHEBI:189564) is a glycerophosphoserine (CHEBI:35766)
IUPAC Name 
(2S)-2-amino-3-[[(2R)-2-dodecanoyloxy-3-[(Z)-octadec-1-enoxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
LMGP03030028LIPID MAPS
113376686ChemSpider