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CHEBI:169191 - PS(24:1(15Z)/24:1(15Z))

ChEBI IDCHEBI:169191
ChEBI NamePS(24:1(15Z)/24:1(15Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC54H102NO10P
Net Charge0
Average Mass956.381
Monoisotopic Mass955.72414
SMILESCCCCCCCC/C=C\CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C54H102NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-52(56)62-47-50(48-63-66(60,61)64-49-51(55)54(58)59)65-53(57)46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,50-51H,3-16,21-49,55H2,1-2H3,(H,58,59)(H,60,61)/b19-17-,20-18-/t50-,51+/m1/s1
InChIKeyPHOVBVVOVGLWCT-YCHNHLRVSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
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(24:1(15Z)/24:1(15Z)) (CHEBI:169191) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
(2S)-2-amino-3-[[(2R)-2,3-bis[[(Z)-tetracos-15-enoyl]oxy]propoxy]-hydroxyphosphoryl]oxypropanoic acid
Manual XrefsDatabases
74876377ChemSpider
HMDB0112934HMDB