DG(i-19:0/i-13:0/0:0) (CHEBI:170304)

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CHEBI:170304 - DG(i-19:0/i-13:0/0:0)

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ChEBI ID	CHEBI:170304
ChEBI Name	DG(i-19:0/i-13:0/0:0)
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C35H68O5
Net Charge	0
Average Mass	568.924
Monoisotopic Mass	568.50668
SMILES	CC(C)CCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCC(C)C
InChI	InChI=1S/C35H68O5/c1-31(2)25-21-17-13-10-8-6-5-7-9-11-15-19-23-27-34(37)39-30-33(29-36)40-35(38)28-24-20-16-12-14-18-22-26-32(3)4/h31-33,36H,5-30H2,1-4H3/t33-/m0/s1
InChIKey	GOHQFNRDUXSQMJ-XIFFEERXSA-N

Species of Metabolite	Component	Source	Comments
Mus musculus (ncbitaxon:10090)	Hepa-RG cell (BTO:0005736)	MetaboLights (MTBLS78)	Strain: C57BL/6J [EFO:0000606]
Homo sapiens (ncbitaxon:9606)
	NIH-3T3 cell (BTO:0000944)	MetaboLights (MTBLS78)
	Hepa-RG cell (BTO:0005736)	MetaboLights (MTBLS78)
	HeLa cell (BTO:0000567)	MetaboLights (MTBLS78)
	HeLa cell;NIH-3T3 cell (BTO:0000944)	MetaboLights (MTBLS78)

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(i-19:0/i-13:0/0:0) (CHEBI:170304) is a 1,2-diglyceride (CHEBI:49172)

IUPAC Name
[(2S)-3-hydroxy-2-(11-methyldodecanoyloxy)propyl] 17-methyloctadecanoate

Manual Xrefs	Databases
HMDB0094019	HMDB
74858493	ChemSpider