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CHEBI:182033 - 8-(3-((1-Ethoxy-2-methyl-1-oxopropan-2-yl)oxy)phenyl)octanoic acid

ChEBI IDCHEBI:182033
ChEBI Name8-(3-((1-Ethoxy-2-methyl-1-oxopropan-2-yl)oxy)phenyl)octanoic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O5
Net Charge0
Average Mass350.455
Monoisotopic Mass350.20932
SMILESCCOC(=O)C(C)(C)Oc1cccc(CCCCCCCC(=O)O)c1
InChIInChI=1S/C20H30O5/c1-4-24-19(23)20(2,3)25-17-13-10-12-16(15-17)11-8-6-5-7-9-14-18(21)22/h10,12-13,15H,4-9,11,14H2,1-3H3,(H,21,22)
InChIKeyBLLVLMYXVKOFGW-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
8-(3-((1-Ethoxy-2-methyl-1-oxopropan-2-yl)oxy)phenyl)octanoic acid (CHEBI:182033) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name 
8-[3-(1-ethoxy-2-methyl-1-oxopropan-2-yl)oxyphenyl]octanoic acid