EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:88498 - DG(16:1(9Z)/20:1(11Z)/0:0)

ChEBI IDCHEBI:88498
ChEBI NameDG(16:1(9Z)/20:1(11Z)/0:0)
Stars
Last Modified26 May 2017
DownloadsMolfile
FormulaC39H72O5
Net Charge0
Average Mass621.000
Monoisotopic Mass620.53798
SMILES[H][C@](CO)(COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C39H72O5/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(42)44-37(35-40)36-43-38(41)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h14,16-18,37,40H,3-13,15,19-36H2,1-2H3/b16-14-,18-17-/t37-/m0/s1
InChIKeyFBCDXXQBGHZSLI-JSTCSLLMSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
Roles Classification
Biological Roles:
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)
DG(16:1(9Z)/20:1(11Z)/0:0) (CHEBI:88498) is a diacylglycerol 36:2 (CHEBI:85701)
IUPAC Name 
(2S)-1-[(9Z)-hexadec-9-enoyloxy]-3-hydroxypropan-2-yl (11Z)-icos-11-enoate
Synonyms  Source
DiacylglycerolHMDB
DG(16:1n7/20:1n9)HMDB
Diacylglycerol(16:1n7/20:1n9)HMDB
DiglycerideHMDB
Diacylglycerol(16:1w7/20:1w9)HMDB
1-Palmitoleoyl-2-eicosenoyl-sn-glycerolHMDB
Manual XrefsDatabases
DIACYLGLYCEROLMetaCyc
HMDB0007137HMDB
LMGL02010054LIPID MAPS
Citations