CHEBI:88386 - Amyl salicylate

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ChEBI Name Amyl salicylate ChEBI ID CHEBI:88386 Stars This entity has been manually annotated by a third party. 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 C12H16O3 Net Charge 0 Average Mass 208.254 Monoisotopic Mass 208.10994 InChI InChI=1S/C12H16O3/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8,13H,2-3,6,9H2,1H3 InChIKey RANVDUNFZBMTBK-UHFFFAOYSA-N SMILES CCCCCOC(C1=CC=CC=C1O)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed ChEBI Ontology Outgoing Amyl salicylate (CHEBI:88386) is a benzoate ester (CHEBI:36054) Synonyms Sources 2-Hydroxybenzoic acid, pentyl ester HMDB Benzoic acid, 2-hydroxy-, pentyl ester HMDB N-Amyl salicylate HMDB pentyl 2-hydroxybenzoate HMDB Pentyl 2-hydroxybenzoate HMDB Pentyl salicylate HMDB Salicylic acid, amyl ester HMDB Salicylic acid, pentyl ester HMDB Manual Xref Database HMDB0038604 HMDB View more database links Registry Number Type Source 2050-08-0 CAS Registry Number KEGG COMPOUND Citation Type Source 24421258 PubMed citation Europe PMC