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CHEBI:206420 - Engyodontiumin A

ChEBI IDCHEBI:206420
ChEBI NameEngyodontiumin A
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SubmitterMetaboLights
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FormulaC12H15ClO4
Net Charge0
Average Mass258.701
Monoisotopic Mass258.06589
SMILESCCCc1c(C(=O)O)cc(OC)c(OC)c1Cl
InChIInChI=1S/C12H15ClO4/c1-4-5-7-8(12(14)15)6-9(16-2)11(17-3)10(7)13/h6H,4-5H2,1-3H3,(H,14,15)
InChIKeyKAAUXIBLINWKFU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Parengyodontium album (ncbitaxon:37998) - DOI (10.1007/s10600-017-1957-8)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Engyodontiumin A (CHEBI:206420) is a methoxybenzoic acid (CHEBI:25238)
IUPAC Name 
3-chloro-4,5-dimethoxy-2-propylbenzoic acid
Manual XrefsDatabases
63002553ChemSpider