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CHEBI:189896 - PS(18:4(6Z,9Z,12Z,15Z)/18:1(11Z))

ChEBI IDCHEBI:189896
ChEBI NamePS(18:4(6Z,9Z,12Z,15Z)/18:1(11Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC42H72NO10P
Net Charge0
Average Mass782.009
Monoisotopic Mass781.48938
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCCCC/C=C\CCCCCC
InChIInChI=1S/C42H72NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,23,25,38-39H,3-4,6,8-10,12,15,18,20-22,24,26-37,43H2,1-2H3,(H,46,47)(H,48,49)/b7-5-,13-11-,16-14-,19-17-,25-23-/t38-,39+/m1/s1
InChIKeyRYWDCVLEZCOWPY-LKIIMJIASA-N
Species of MetaboliteComponentSourceComments
marine plankton environmental sample (ncbitaxon:632957) endometabolome MetaboLights (MTBLS3038)
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
PS(18:4(6Z,9Z,12Z,15Z)/18:1(11Z)) (CHEBI:189896) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-3-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxy-2-[(Z)-octadec-11-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
74875934ChemSpider
HMDB0112491HMDB