CHEBI:88639 - Ethylhexyl salicylate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name Ethylhexyl salicylate ChEBI ID CHEBI:88639 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 C15H22O3 Net Charge 0 Average Mass 250.334 Monoisotopic Mass 250.15689 InChI InChI=1S/C15H22O3/c1-3-5-8-12(4-2)11-18-15(17)13-9-6-7-10-14(13)16/h6-7,9-10,12,16H,3-5,8,11H2,1-2H3 InChIKey FMRHJJZUHUTGKE-UHFFFAOYSA-N SMILES CCCCC(CC)COC(C1=CC=CC=C1O)=O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed ChEBI Ontology Outgoing Ethylhexyl salicylate (CHEBI:88639) has functional parent salicylic acid (CHEBI:16914) Ethylhexyl salicylate (CHEBI:88639) is a benzoate ester (CHEBI:36054) Ethylhexyl salicylate (CHEBI:88639) is a phenols (CHEBI:33853) Synonyms Sources 2-ethylhexyl 2-hydroxybenzoate HMDB Ethylhexyl salicylic acid HMDB octyl salicylate DrugCentral Manual Xrefs Databases 4241 DrugCentral HMDB0061839 HMDB View more database links Registry Number Type Source 118-60-5 CAS Registry Number DrugCentral Citations Types Sources 14617432 PubMed citation Europe PMC 16956469 PubMed citation Europe PMC 18498482 PubMed citation Europe PMC 18966155 PubMed citation Europe PMC 18967342 PubMed citation Europe PMC 20233542 PubMed citation Europe PMC 24421258 PubMed citation Europe PMC Last Modified 22 February 2017