EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:185010 - PS(18:4(6Z,9Z,12Z,15Z)/0:0)

ChEBI IDCHEBI:185010
ChEBI NamePS(18:4(6Z,9Z,12Z,15Z)/0:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H40NO9P
Net Charge0
Average Mass517.556
Monoisotopic Mass517.24407
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@@H](O)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C24H40NO9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(27)32-18-21(26)19-33-35(30,31)34-20-22(25)24(28)29/h3-4,6-7,9-10,12-13,21-22,26H,2,5,8,11,14-20,25H2,1H3,(H,28,29)(H,30,31)/b4-3-,7-6-,10-9-,13-12-/t21-,22+/m1/s1
InChIKeyAVZYBIVBKFHKKK-ZAFJSTQKSA-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(18:4(6Z,9Z,12Z,15Z)/0:0) (CHEBI:185010) is a 1-acyl-sn-glycero-3-phosphoserine (CHEBI:52603)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-2-hydroxy-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
LMGP03050018LIPID MAPS
113376754ChemSpider