CHEBI:231192 - DG(12:0/18:1(12Z)-O(9S,10R)/0:0)

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ChEBI Name DG(12:0/18:1(12Z)-O(9S,10R)/0:0)
ChEBI ID CHEBI:231192
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C33H60O6
Net Charge 0
Average Mass 552.837
Monoisotopic Mass 552.43899
InChI InChI=1S/C33H60O6/c1-3-5-7-9-11-12-13-17-21-25-32(35)37-28-29(27-34)38-33(36)26-22-18-14-16-20-24-31-30(39-31)23-19-15-10-8-6-4-2/h15,19,29-31,34H,3-14,16-18,20-28H2,1-2H3/b19-15-/t29-,30?,31?/m0/s1
InChIKey LITIJTZLGLUHRG-FVGXFSABSA-N
SMILES O1C(C1C/C=C\CCCCC)CCCCCCCC(O[C@H](COC(=O)CCCCCCCCCCC)CO)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
(via diglyceride )
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via diglyceride )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing DG(12:0/18:1(12Z)-O(9S,10R)/0:0) (CHEBI:231192) is a 1,2-diglyceride (CHEBI:49172)
IUPAC Name
[(2S)-3-hydroxy-2-[8-[3-[(Z)-oct-2-enyl]oxiran-2-yl]octanoyloxy]propyl] dodecanoate
Manual Xrefs Databases
117213928 ChemSpider
HMDB0294725 HMDB
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