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CHEBI:84513 - 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine

ChEBI IDCHEBI:84513
ChEBI Name1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine
Stars
ASCII Name1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine
DefinitionA 3-sn-phosphatidyl L-serine in which the phosphatidyl acyl groups at positions 1 and 2 are stearoyl and (9Z,12Z)-octadecadienoyl respectively.
Last Modified4 March 2016
Submitternamrata
DownloadsMolfile
FormulaC42H78NO10P
Net Charge0
Average Mass788.057
Monoisotopic Mass787.53633
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C42H78NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,38-39H,3-11,13,15-17,19,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b14-12-,20-18-/t38-,39+/m1/s1
InChIKeyAGTPCXBHIGMTEU-NREGDSCDSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
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 Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:84513) has functional parent linoleic acid (CHEBI:17351)
1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:84513) has functional parent octadecanoic acid (CHEBI:28842)
1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:84513) has role mouse metabolite (CHEBI:75771)
1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:84513) is a phosphatidylserine(18:0/18:2) (CHEBI:90434)
1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:84513) is conjugate acid of 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine(1−) (CHEBI:84466)
Incoming Relation(s)
1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine(1−) (CHEBI:84466) is conjugate base of 1-stearoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:84513)
IUPAC Name 
O-{hydroxy[(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-3-(octadecanoyloxy)propoxy]phosphoryl}-L-serine
Synonyms  Source
1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphoserineChEBI
1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho-L-serineChEBI
1-stearoyl-2-linoleoyl-sn-glycero-3-phosphoserineChEBI
Phosphatidylserine(18:0/18:2)HMDB
Phosphatidylserine(18:0/18:2n6)HMDB
Phosphatidylserine(18:0/18:2w6)HMDB
Manual XrefsDatabases
HMDB0012380HMDB
LMGP03010031LIPID MAPS