DG(44:2) (CHEBI:189594)

CHEBI:189594 - DG(44:2)

Formula	C47H88O5
Net Charge	0
Average Mass	733.216
Monoisotopic Mass	732.66318
SMILES	CCCCC/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCCCCCCCCCC
InChI	InChI=1S/C47H88O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46(49)51-44-45(43-48)52-47(50)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,45,48H,3-11,13,15-17,19,21-44H2,1-2H3/b14-12-,20-18-/t45-/m0/s1
InChIKey	XIMNXKOUCJXPFV-LGJUANINSA-N

Roles Classification

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(44:2) (CHEBI:189594) is a 1,2-diglyceride (CHEBI:49172)

IUPAC Name
[(2S)-2-[(13Z,16Z)-docosa-13,16-dienoyl]oxy-3-hydroxypropyl] docosanoate