CHEBI:88553 - (2S)-2-Ethylhexyl acetate

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ChEBI Name (2S)-2-Ethylhexyl acetate
ChEBI ID CHEBI:88553
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C10H20O2
Net Charge 0
Average Mass 172.265
Monoisotopic Mass 172.14633
InChI InChI=1S/C10H20O2/c1-4-6-7-10(5-2)8-12-9(3)11/h10H,4-8H2,1-3H3/t10-/m0/s1
InChIKey WOYWLLHHWAMFCB-JTQLQIEISA-N
SMILES CCCC[C@](CC)(COC(C)=O)[H]
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed
ChEBI Ontology
Outgoing (2S)-2-Ethylhexyl acetate (CHEBI:88553) is a acetate salt (CHEBI:59230)
Synonyms Sources
(2S)-2-ethylhexyl acetate HMDB
(2S)-2-Ethylhexyl acetic acid HMDB
Manual Xref Database
HMDB0061805 HMDB
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Citation Waiting for Citations Type Source
24421258 PubMed citation Europe PMC