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CHEBI:77248 - 1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate

ChEBI IDCHEBI:77248
ChEBI Name1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate
Stars
ASCII Name1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate
DefinitionA 1-acyl-2-linoleoyl-sn-glycero-3-phosphate in which the 1-acyl group is specified as stearoyl (octadecanoyl).
Last Modified13 January 2017
SubmitterSteve
DownloadsMolfile
FormulaC39H73O8P
Net Charge0
Average Mass700.979
Monoisotopic Mass700.50431
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(=O)(O)O
InChIInChI=1S/C39H73O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,37H,3-11,13,15-17,19,21-36H2,1-2H3,(H2,42,43,44)/b14-12-,20-18-/t37-/m1/s1
InChIKeyQYYWMYCDFOLKKH-DAKWMOBOSA-N
Roles Classification
Biological Role:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
ChEBI Ontology
Outgoing Relation(s)
1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate (CHEBI:77248) has functional parent octadecanoic acid (CHEBI:28842)
1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate (CHEBI:77248) is a 1-acyl-2-linoleoyl-sn-glycero-3-phosphate (CHEBI:75110)
1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate (CHEBI:77248) is a phosphatidic acid 36:2 (CHEBI:134237)
1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate (CHEBI:77248) is conjugate acid of 1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate(2−) (CHEBI:77098)
Incoming Relation(s)
1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate(2−) (CHEBI:77098) is conjugate base of 1-stearoyl-2-linoleoyl-sn-glycero-3-phosphate (CHEBI:77248)
IUPAC Name 
(2R)-3-(octadecanoyloxy)-1-(phosphonooxy)propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms  Source
1-octadecanoyl-2-(9Z,12Z)-octadecadienoyl-sn-glycero-3-phosphateChEBI
PA(18:0/18:2(9Z,12Z))LIPID MAPS
1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phosphateLIPID MAPS
PA(18:0/18:2ω6)HMDB
PA(18:0/18:2n6)HMDB
PA(18:0/18:2)LIPID MAPS
Manual XrefsDatabases
LMGP10010036LIPID MAPS
HMDB0007861HMDB
CPD-8267MetaCyc