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CHEBI:89241 - 1-α-linolenoyl-2-icosanoyl-sn-glycerol

ChEBI IDCHEBI:89241
ChEBI Name1-α-linolenoyl-2-icosanoyl-sn-glycerol
Stars
ASCII Name1-alpha-linolenoyl-2-icosanoyl-sn-glycerol
DefinitionA 1,2-diacyl-sn-glycerol in which the acyl groups positions 1 and 2 are specified as α-linolenoyl and icosanoyl (arachidoyl) respectively.
Last Modified6 November 2018
DownloadsMolfile
FormulaC41H74O5
Net Charge0
Average Mass647.038
Monoisotopic Mass646.55363
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C41H74O5/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/h6,8,12,14,18,21,39,42H,3-5,7,9-11,13,15-17,19-20,22-38H2,1-2H3/b8-6-,14-12-,21-18-/t39-/m0/s1
InChIKeyKYOOZXPNLNVRQD-CVALLSOGSA-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-icosanoyl-sn-glycerol (CHEBI:89241) has functional parent icosanoic acid (CHEBI:28822)
1-α-linolenoyl-2-icosanoyl-sn-glycerol (CHEBI:89241) has functional parent α-linolenic acid (CHEBI:27432)
1-α-linolenoyl-2-icosanoyl-sn-glycerol (CHEBI:89241) has role human blood serum metabolite (CHEBI:85234)
1-α-linolenoyl-2-icosanoyl-sn-glycerol (CHEBI:89241) is a 1,2-diacyl-sn-glycerol (CHEBI:17815)
1-α-linolenoyl-2-icosanoyl-sn-glycerol (CHEBI:89241) is a diacylglycerol 38:3 (CHEBI:85706)
IUPAC Name 
(2S)-1-hydroxy-3-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}propan-2-yl icosanoate
Synonyms  Source
Diacylglycerol(18:3w3/20:0)HMDB
DAG(18:3w3/20:0)HMDB
Diacylglycerol(18:3n3/20:0)HMDB
DAG(38:3)HMDB
DG(18:3w3/20:0)HMDB
DAG(18:3/20:0)HMDB
Manual XrefsDatabases
HMDB0007310HMDB
Citations