CHEBI:131410 - t-butyl hexadecanoate

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ChEBI Name t-butyl hexadecanoate ChEBI ID CHEBI:131410 Definition A hexadecanoate ester in which the carboxy hydrogen of hexadecanoic acid has been replaced by a tert-butyl group. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C20H40O2 Net Charge 0 Average Mass 312.531 Monoisotopic Mass 312.30283 InChI InChI=1S/C20H40O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(21)22-20(2,3)4/h5-18H2,1-4H3 InChIKey QESUPNPIYGFLCJ-UHFFFAOYSA-N SMILES C(CCCCCCCCCC)CCCCC(OC(C)(C)C)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) See: PubMed Homo sapiens (NCBI:txid9606) See: MetaboLights Study ChEBI Ontology Outgoing t-butyl hexadecanoate (CHEBI:131410) is a tert-butyl ester (CHEBI:140402) t-butyl hexadecanoate (CHEBI:131410) is a hexadecanoate ester (CHEBI:25835) IUPAC Name tert-butyl hexadecanoate Synonyms Sources hexadecanoic acid tert-butyl ester ChEBI palmitic acid tert-butyl ester ChEBI t-butyl palmitate ChEBI tert-butyl palmitate ChEBI Manual Xref Database 474139 ChemSpider View more database links Registry Number Type Source 1790068 Reaxys Registry Number Reaxys Last Modified 09 March 2018