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CHEBI:189327 - Differanisole A

ChEBI IDCHEBI:189327
ChEBI NameDifferanisole A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12Cl2O4
Net Charge0
Average Mass279.119
Monoisotopic Mass278.01126
SMILESCCCc1c(Cl)c(OC)c(Cl)c(O)c1C(=O)O
InChIInChI=1S/C11H12Cl2O4/c1-3-4-5-6(11(15)16)9(14)8(13)10(17-2)7(5)12/h14H,3-4H2,1-2H3,(H,15,16)
InChIKeyNKSHOWDKAJTSJO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Differanisole A (CHEBI:189327) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name 
3,5-dichloro-2-hydroxy-4-methoxy-6-propylbenzoic acid
Manual XrefsDatabases
129497ChemSpider
Registry NumbersSources
CAS:94474-29-0ChemIDplus