EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:75096 - 1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine

ChEBI IDCHEBI:75096
ChEBI Name1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine
Stars
ASCII Name1-oleoyl-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 specified as oleoyl and linoleoyl respectively.
Last Modified26 May 2017
SubmitterSteve
DownloadsMolfile
FormulaC42H76NO10P
Net Charge0
Average Mass786.041
Monoisotopic Mass785.52068
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(O)OC[C@H](N)C(=O)O
InChIInChI=1S/C42H76NO10P/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/h12,14,17-20,38-39H,3-11,13,15-16,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b14-12-,19-17-,20-18-/t38-,39+/m1/s1
InChIKeyMWONMGIZXLAUBR-QUBHBNJHSA-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)
1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:75096) has functional parent linoleic acid (CHEBI:17351)
1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:75096) has functional parent oleic acid (CHEBI:16196)
1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:75096) is a phosphatidylserine(18:1/18:2) (CHEBI:137156)
1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:75096) is conjugate acid of 1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine(1−) (CHEBI:74892)
Incoming Relation(s)
1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine(1−) (CHEBI:74892) is conjugate base of 1-oleoyl-2-linoleoyl-sn-glycero-3-phospho-L-serine (CHEBI:75096)
IUPAC Name 
O-(hydroxy{(2R)-2-[(9Z,12Z)-octadeca-9,12-dienoyloxy]-3-[(9Z)-octadec-9-enoyloxy]propoxy}phosphoryl)-L-serine
Synonyms  Source
1-C18:1(ω-9)-2-C18:2(ω-6)-phosphatidylserineChEBI
1-(9Z)-octadecenoyl-2-(9Z,12Z)-octadienoyl-sn-glycero-3-phospho-L-serineChEBI
PS(18:1(9Z)/18:2(9Z,12Z))LIPID MAPS
1-(9Z-octadecenoyl)-2-(9Z,12Z-octadecadienoyl)-glycero-3-phosphoserineLIPID MAPS
Phosphatidylserine(36:3)HMDB
PS(36:3)HMDB
Manual XrefsDatabases
LMGP03010958LIPID MAPS
HMDB0012391HMDB
CPD-8338MetaCyc