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CHEBI:187601 - PS(O-16:0/18:2(9Z,12Z))

ChEBI IDCHEBI:187601
ChEBI NamePS(O-16:0/18:2(9Z,12Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H76NO9P
Net Charge0
Average Mass746.020
Monoisotopic Mass745.52577
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C40H76NO9P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-39(42)50-37(35-48-51(45,46)49-36-38(41)40(43)44)34-47-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,37-38H,3-10,12,14-16,18,20-36,41H2,1-2H3,(H,43,44)(H,45,46)/b13-11-,19-17-/t37-,38+/m1/s1
InChIKeySPIGMOHFOCAURT-BCWBHBCESA-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-16:0/18:2(9Z,12Z)) (CHEBI:187601) is a ether lipid (CHEBI:64611)
PS(O-16:0/18:2(9Z,12Z)) (CHEBI:187601) is a glycerophosphoserine (CHEBI:35766)
IUPAC Name 
(2S)-2-amino-3-[[(2R)-3-hexadecoxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376644ChemSpider
LMGP03020079LIPID MAPS