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CHEBI:187788 - PG-PS

ChEBI IDCHEBI:187788
ChEBI NamePG-PS
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H50NO12P
Net Charge0
Average Mass611.666
Monoisotopic Mass611.30706
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCC(=O)O
InChIInChI=1S/C27H50NO12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-25(31)37-19-22(40-26(32)18-15-16-24(29)30)20-38-41(35,36)39-21-23(28)27(33)34/h22-23H,2-21,28H2,1H3,(H,29,30)(H,33,34)(H,35,36)/t22-,23+/m1/s1
InChIKeyGLCJANLAKISVBJ-PKTZIBPZSA-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)
PG-PS (CHEBI:187788) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
5-[(2R)-1-[[(2S)-2-amino-2-carboxyethoxy]-hydroxyphosphoryl]oxy-3-hexadecanoyloxypropan-2-yl]oxy-5-oxopentanoic acid
Manual XrefsDatabases
113380894ChemSpider
LMGP20040016LIPID MAPS