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CHEBI:89239 - 1-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol

Default Structure
ChEBI IDCHEBI:89239
ChEBI Name1-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol
Stars
ASCII Name1-alpha-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol
DefinitionA 1,2-diacyl-sn-glycerol in which the acyl groups positions 1 and 2 are specified as α-linolenoyl and (11Z,14Z)-icosadienoyl respectively.
Last Modified23 March 2016
DownloadsMolfile
FormulaC41H70O5
Net Charge0
Average Mass643.006
Monoisotopic Mass642.52233
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C41H70O5/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(44)46-39(37-42)38-45-40(43)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-19,21,39,42H,3-5,7,9-10,15-16,20,22-38H2,1-2H3/b8-6-,13-11-,14-12-,19-17-,21-18-/t39-/m0/s1
InChIKeyGRGDLDNREYVILP-CNWVQWJYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood (UBERON:0000178) PubMed (20671299)
Roles Classification
Biological Roles:
human blood serum metabolite  Any metabolite (endogenous or exogenous) found in human blood serum samples.
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-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol (CHEBI:89239) has functional parent (11Z,14Z)-icosadienoic acid (CHEBI:73731)
1-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol (CHEBI:89239) has functional parent α-linolenic acid (CHEBI:27432)
1-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol (CHEBI:89239) has role human blood serum metabolite (CHEBI:85234)
1-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol (CHEBI:89239) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
1-α-linolenoyl-2-[(11Z,14Z)-icosadienoyl]-sn-glycerol (CHEBI:89239) is a diacylglycerol 38:5 (CHEBI:85704)
IUPAC Name 
(2S)-1-hydroxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propan-2-yl (11Z,14Z)-icosa-11,14-dienoate
Synonyms  Source
1-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]-2-[(11Z,14Z)-icosa-11,14-dienoyl]-sn-glycerolChEBI
1-[(9Z,12Z,15Z)-octadecatrienoyl]-2-[(11Z,14Z)-icosadienoyl]-sn-glycerolChEBI
1-alpha-Linolenoyl-2-eicosadienoyl-sn-glycerolHMDB
DAG(18:3/20:2)HMDB
DAG(18:3n3/20:2n6)HMDB
DAG(18:3w3/20:2w6)HMDB
Manual XrefsDatabases
HMDB0007312HMDB
Citations