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CHEBI:192122 - 2-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]acetic acid

ChEBI IDCHEBI:192122
ChEBI Name2-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]acetic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H16O5
Net Charge0
Average Mass252.266
Monoisotopic Mass252.09977
SMILESCC(C)=CCc1c(O)cc(O)c(CC(=O)O)c1O
InChIInChI=1S/C13H16O5/c1-7(2)3-4-8-10(14)6-11(15)9(13(8)18)5-12(16)17/h3,6,14-15,18H,4-5H2,1-2H3,(H,16,17)
InChIKeyJGBMKZWTRNSXQV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]acetic acid (CHEBI:192122) is a phenols (CHEBI:33853)
2-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]acetic acid (CHEBI:192122) is a phenylacetic acids (CHEBI:25978)
IUPAC Name 
2-[2,4,6-trihydroxy-3-(3-methylbut-2-enyl)phenyl]acetic acid
Manual XrefsDatabases
HMDB0125460HMDB
74851719ChemSpider