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CHEBI:188025 - PS(20:3(8Z,11Z,14Z)/19:1(9Z))

ChEBI IDCHEBI:188025
ChEBI NamePS(20:3(8Z,11Z,14Z)/19:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC45H80NO10P
Net Charge0
Average Mass826.106
Monoisotopic Mass825.55198
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCC/C=C\CCCCCCCCC
InChIInChI=1S/C45H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-43(47)53-38-41(39-54-57(51,52)55-40-42(46)45(49)50)56-44(48)37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19-20,22-24,41-42H,3-10,12,14-16,18,21,25-40,46H2,1-2H3,(H,49,50)(H,51,52)/b13-11-,19-17-,22-20-,24-23-/t41-,42+/m1/s1
InChIKeySQWVDKSCEGWEHI-CAWWIDELSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
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(20:3(8Z,11Z,14Z)/19:1(9Z)) (CHEBI:188025) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-3-[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxy-2-[(Z)-nonadec-9-enoyl]oxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
113376410ChemSpider
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