CHEBI:190788 - 5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pentanoic acid

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ChEBI Name 5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pentanoic acid
ChEBI ID CHEBI:190788
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O4
Net Charge 0
Average Mass 266.337
Monoisotopic Mass 266.15181
InChI InChI=1S/C15H22O4/c1-10-9-13(11(2)8-12(10)16)19-7-5-6-15(3,4)14(17)18/h8-9,16H,5-7H2,1-4H3,(H,17,18)
InChIKey VJICDPYDJADQNH-UHFFFAOYSA-N
SMILES O(CCCC(C)(C)C(O)=O)C=1C(=CC(O)=C(C1)C)C
Metabolite of Species Details
Oryza sativa (NCBI:txid4530) Found in root (BTO:0001188). See: MetaboLights Study
ChEBI Ontology
Outgoing 5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pentanoic acid (CHEBI:190788) is a aromatic ether (CHEBI:35618)
5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethyl-Pentanoic acid (CHEBI:190788) is a phenols (CHEBI:33853)
IUPAC Name
5-(4-hydroxy-2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid
Manual Xref Database
8621049 ChemSpider
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Registry Number Type Source
80373-12-2 CAS Registry Number ChemIDplus