CHEBI:88156 - diacetin

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ChEBI Name diacetin ChEBI ID CHEBI:88156 Definition A diglyceride resulting from the formal condensation of any two of the hydroxy groups of glycerol with the carboxy groups of two molecules of acetic acid (either R1 = H and R2 = Ac, or R1 = Ac and R2 = H). Stars This entity has been manually annotated by the ChEBI Team. Submitter AnneNiknejad Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H12O5 Net Charge 0 Average Mass (excl. R groups) 176.167 Monoisotopic Mass (excl. R groups) 176.06847 SMILES O(CC(COC(=O)C)O*)* 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 diacetin (CHEBI:88156) is a acetate ester (CHEBI:47622) diacetin (CHEBI:88156) is a alcohol (CHEBI:30879) diacetin (CHEBI:88156) is a diester (CHEBI:51307) diacetin (CHEBI:88156) is a diglyceride (CHEBI:18035) Synonyms Sources 1,2,3 propanetriol diacetate NIST Chemistry WebBook diacetylglycerol UniProt diacetylglycerol ChemIDplus glycerin diacetate ChemIDplus glycerine diacetate ChemIDplus glycerol diacetate ChemIDplus glyceryl diacetate ChemIDplus propane-1,2,3-triol diacetate ChEBI Registry Numbers Types Sources 25395-31-7 CAS Registry Number NIST Chemistry WebBook 25395-31-7 CAS Registry Number ChemIDplus Citations Types Sources 15373841 PubMed citation SUBMITTER 22113024 PubMed citation Europe PMC 26245141 PubMed citation Europe PMC Last Modified 08 January 2016