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CHEBI:229035 - 7,8-Dihydroxy-isobutyryl-thymol

ChEBI IDCHEBI:229035
ChEBI Name7,8-Dihydroxy-isobutyryl-thymol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H20O5
Net Charge0
Average Mass268.309
Monoisotopic Mass268.13107
SMILESCC(C)C(=O)OCC(C)(O)c1ccc(CO)cc1O
InChIInChI=1S/C14H20O5/c1-9(2)13(17)19-8-14(3,18)11-5-4-10(7-15)6-12(11)16/h4-6,9,15-16,18H,7-8H2,1-3H3
InChIKeyOHCHAAIKJDAFAY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
7,8-Dihydroxy-isobutyryl-thymol (CHEBI:229035) is a benzyl alcohols (CHEBI:22743)
IUPAC Name 
[2-hydroxy-2-[2-hydroxy-4-(hydroxymethyl)phenyl]propyl] 2-methylpropanoate
Manual XrefsDatabases
4475763ChemSpider