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CHEBI:230814 - ps(o-20:0/22:1(11z))

Default Structure
ChEBI IDCHEBI:230814
ChEBI Nameps(o-20:0/22:1(11z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H94NO9P
Net Charge0
Average Mass860.252
Monoisotopic Mass859.66662
SMILESCCCCCCCCCC/C=C\CCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C48H94NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-47(50)58-45(43-56-59(53,54)57-44-46(49)48(51)52)42-55-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h21,23,45-46H,3-20,22,24-44,49H2,1-2H3,(H,51,52)(H,53,54)/b23-21-/t45-,46+/m1/s1
InChIKeyYTBBYJLQETZTFX-YDSXGUOBSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
ps(o-20:0/22:1(11z)) (CHEBI:230814) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
(2S)-2-amino-3-[[(2R)-2-[(Z)-docos-11-enoyl]oxy-3-icosoxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376631ChemSpider
LMGP03020066LIPID MAPS