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CHEBI:77097 - 1-stearoyl-2-linoleoyl-sn-glycerol

ChEBI IDCHEBI:77097
ChEBI Name1-stearoyl-2-linoleoyl-sn-glycerol
Stars
ASCII Name1-stearoyl-2-linoleoyl-sn-glycerol
DefinitionA 1,2-diacyl-sn-glycerol in which the acyl groups at positions 1 and 2 are specified as stearoyl and linoleoyl respectively.
Last Modified23 October 2015
Submitterlaimo
DownloadsMolfile
FormulaC39H72O5
Net Charge0
Average Mass621.000
Monoisotopic Mass620.53798
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-36-37(35-40)44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,37,40H,3-11,13,15-17,19,21-36H2,1-2H3/b14-12-,20-18-/t37-/m0/s1
InChIKeyAJMZUFBKADIAKC-SKTOPKGQSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-stearoyl-2-linoleoyl-sn-glycerol (CHEBI:77097) has functional parent linoleic acid (CHEBI:17351)
1-stearoyl-2-linoleoyl-sn-glycerol (CHEBI:77097) has functional parent octadecanoic acid (CHEBI:28842)
1-stearoyl-2-linoleoyl-sn-glycerol (CHEBI:77097) has role mouse metabolite (CHEBI:75771)
1-stearoyl-2-linoleoyl-sn-glycerol (CHEBI:77097) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
1-stearoyl-2-linoleoyl-sn-glycerol (CHEBI:77097) is a diacylglycerol 36:2 (CHEBI:85701)
IUPAC Name 
(2S)-1-hydroxy-3-(octadecanoyloxy)propan-2-yl (9Z,12Z)-octadeca-9,12-dienoate
Synonyms  Source
1,2-DG 18:0/18:2(ω-6)SUBMITTER
DG(18:0/18:2/0:0)LIPID MAPS
DG(18:0/18:2(9Z,12Z)/0:0)LIPID MAPS
1-octadecanoyl-2-(9Z,12Z-octadecadienoyl)-sn-glycerolLIPID MAPS
DG(36:2)HMDB
DG(18:0/18:2)HMDB
UniProt Name  Source
1-octadecanoyl-2-(9Z,12Z)-octadecadienoyl-sn-glycerolUniProt
Manual XrefsDatabases
LMGL02010050LIPID MAPS
HMDB0007161HMDB
Registry NumbersSources
Reaxys:2068198Reaxys
CAS:34487-26-8ChemIDplus
Citations