DG(a-15:0/0:0/17:0) (CHEBI:170357)

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CHEBI:170357 - DG(a-15:0/0:0/17:0)

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ChEBI ID	CHEBI:170357
ChEBI Name	DG(a-15:0/0:0/17:0)
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C35H68O5
Net Charge	0
Average Mass	568.924
Monoisotopic Mass	568.50668
SMILES	CCCCCCCCCCCCCCCCC(=O)OC[C@H](O)COC(=O)CCCCCCCCCCC(C)CC
InChI	InChI=1S/C35H68O5/c1-4-6-7-8-9-10-11-12-13-14-15-19-22-25-28-34(37)39-30-33(36)31-40-35(38)29-26-23-20-17-16-18-21-24-27-32(3)5-2/h32-33,36H,4-31H2,1-3H3/t32?,33-/m0/s1
InChIKey	LSMVLVYVQRJFKW-OBOZPERJSA-N

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

Roles Classification

Biological Roles:

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 ).

ChEBI Ontology

Outgoing Relation(s)
	DG(a-15:0/0:0/17:0) (CHEBI:170357) is a 1,3-diglyceride (CHEBI:47777)

IUPAC Name
[(2S)-2-hydroxy-3-(12-methyltetradecanoyloxy)propyl] heptadecanoate

Manual Xrefs	Databases
59692846	ChemSpider
HMDB0093775	HMDB