EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:179126 - PS(20:2(11Z,14Z)/14:0)

ChEBI IDCHEBI:179126
ChEBI NamePS(20:2(11Z,14Z)/14:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H74NO10P
Net Charge0
Average Mass760.003
Monoisotopic Mass759.50503
SMILESCCCCC/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@H](N)C(=O)O)OC(=O)CCCCCCCCCCCCC
InChIInChI=1S/C40H74NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-23-25-27-29-31-38(42)48-33-36(34-49-52(46,47)50-35-37(41)40(44)45)51-39(43)32-30-28-26-24-21-14-12-10-8-6-4-2/h11,13,16-17,36-37H,3-10,12,14-15,18-35,41H2,1-2H3,(H,44,45)(H,46,47)/b13-11-,17-16-/t36-,37+/m1/s1
InChIKeyLNDXHOFZTXDALI-MUCYIZALSA-N
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(20:2(11Z,14Z)/14:0) (CHEBI:179126) is a phosphatidyl-L-serine (CHEBI:18303)
IUPAC Name 
(2S)-2-amino-3-[hydroxy-[(2R)-3-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-2-tetradecanoyloxypropoxy]phosphoryl]oxypropanoic acid
Manual XrefsDatabases
74876010ChemSpider
HMDB0112567HMDB
LMGP03010560LIPID MAPS