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> Main
CHEBI:88639 - Ethylhexyl salicylate
Main
ChEBI Ontology
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ChEBI Name
Ethylhexyl salicylate
ChEBI ID
CHEBI:88639
Stars
This entity has been manually annotated by a third party.
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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