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CHEBI:184141 - PS(22:4(7Z,10Z,13Z,16Z)/0:0)

ChEBI IDCHEBI:184141
ChEBI NamePS(22:4(7Z,10Z,13Z,16Z)/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H48NO9P
Net Charge0
Average Mass573.664
Monoisotopic Mass573.30667
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C28H48NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(31)36-22-25(30)23-37-39(34,35)38-24-26(29)28(32)33/h6-7,9-10,12-13,15-16,25-26,30H,2-5,8,11,14,17-24,29H2,1H3,(H,32,33)(H,34,35)/b7-6-,10-9-,13-12-,16-15-/t25-,26+/m1/s1
InChIKeyJTHCCKGEGXLBGO-BIVCQWAISA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3725)
ChEBI Ontology
Outgoing Relation(s)
PS(22:4(7Z,10Z,13Z,16Z)/0:0) (CHEBI:184141) is a 1-acyl-sn-glycero-3-phosphoserine (CHEBI:52603)
IUPAC Name 
(2S)-2-amino-3-[[(2R)-3-[(7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoyl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376750ChemSpider
LMGP03050014LIPID MAPS