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CHEBI:185484 - PS(13:0/18:4(6Z,9Z,12Z,15Z))

ChEBI IDCHEBI:185484
ChEBI NamePS(13:0/18:4(6Z,9Z,12Z,15Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H64NO10P
Net Charge0
Average Mass713.890
Monoisotopic Mass713.42678
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C37H64NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-36(40)48-33(31-46-49(43,44)47-32-34(38)37(41)42)30-45-35(39)28-26-24-22-20-14-12-10-8-6-4-2/h5,7,11,13,16-17,19,21,33-34H,3-4,6,8-10,12,14-15,18,20,22-32,38H2,1-2H3,(H,41,42)(H,43,44)/b7-5-,13-11-,17-16-,21-19-/t33-,34+/m1/s1
InChIKeyOCNFGCPYQYUJSA-ZHGPMTGKSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
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(13:0/18:4(6Z,9Z,12Z,15Z)) (CHEBI:185484) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxy-3-tridecanoyloxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376108ChemSpider
LMGP03010081LIPID MAPS