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CHEBI:88386 - Amyl salicylate

ChEBI IDCHEBI:88386
ChEBI NameAmyl salicylate
Stars
DownloadsMolfile
FormulaC12H16O3
Net Charge0
Average Mass208.257
Monoisotopic Mass208.10994
SMILESCCCCCOC(=O)c1ccccc1O
InChIInChI=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
InChIKeyRANVDUNFZBMTBK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) saliva (UBERON:0001836) PubMed (24421258)
ChEBI Ontology
Outgoing Relation(s)
Amyl salicylate (CHEBI:88386) is a benzoate ester (CHEBI:36054)
Synonyms  Source
N-Amyl salicylateHMDB
Salicylic acid, pentyl esterHMDB
Benzoic acid, 2-hydroxy-, pentyl esterHMDB
pentyl 2-hydroxybenzoateHMDB
Salicylic acid, amyl esterHMDB
2-Hydroxybenzoic acid, pentyl esterHMDB
Manual XrefsDatabases
HMDB0038604HMDB
Registry NumbersSources
CAS:2050-08-0KEGG COMPOUND
Citations