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CHEBI:75468 - 1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol

ChEBI IDCHEBI:75468
ChEBI Name1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol
Stars
ASCII Name1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol
DefinitionA 1,2-diacyl-sn-glycerol that has stearoyl and oleoyl as the 1- and 2-acyl groups respectively.
Secondary ChEBI IDCHEBI:86981
Last Modified9 March 2017
Submitterlaimo, namrata
DownloadsMolfile
FormulaC39H74O5
Net Charge0
Average Mass623.016
Monoisotopic Mass622.55363
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C39H74O5/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/h18,20,37,40H,3-17,19,21-36H2,1-2H3/b20-18-/t37-/m0/s1
InChIKeySAEPUUXWQQNLGN-LVVMQYBKSA-N
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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).
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-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468) has role mouse metabolite (CHEBI:75771)
1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468) is a 1-stearoyl-2-oleoylglycerol (CHEBI:75590)
1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468) is a diacylglycerol 36:1 (CHEBI:86980)
1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468) is enantiomer of 2-oleoyl-3-stearoyl-sn-glycerol (CHEBI:75558)
Incoming Relation(s)
rac-1-stearoyl-2-oleoylglycerol (CHEBI:75560) has part 1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468)
2-oleoyl-3-stearoyl-sn-glycerol (CHEBI:75558) is enantiomer of 1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol (CHEBI:75468)
IUPAC Name 
(2S)-1-hydroxy-3-(octadecanoyloxy)propan-2-yl (9Z)-octadec-9-enoate
Synonym  Source
DG (18:0/18:1(n-9)/0:0)SUBMITTER
UniProt Name  Source
1-octadecanoyl-2-(9Z-octadecenoyl)-sn-glycerolUniProt
Manual XrefsDatabases
LMGL02010043LIPID MAPS
HMDB0007160HMDB
Registry NumbersSources
CAS:53702-48-0ChemIDplus