CHEBI:64977 - cichorine

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ChEBI Name cichorine ChEBI ID CHEBI:64977 Definition A member of the class of isoindoles that is 6-hydroxy-4-methoxy-5-methyl-2,3-dihydro-1H-isoindol-1-one which is substituted at position 4, 5, and 6 by methoxy, methyl, and hydroxy groups, respectively. A secondary metabolite found in Aspergillus silvativus, Aspergillus nidulans and Alternaria cichorii, it is poisonous to Russian knapweed (Acroptilon repens). Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:3694 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C10H11NO3 Net Charge 0 Average Mass 193.19920 Monoisotopic Mass 193.07389 InChI InChI=1S/C10H11NO3/c1-5-8(12)3-6-7(9(5)14-2)4-11-10(6)13/h3,12H,4H2,1-2H3,(H,11,13) InChIKey ICZVDXDXJQCDOJ-UHFFFAOYSA-N SMILES COc1c(C)c(O)cc2C(=O)NCc12 Roles Classification Biological Role(s): mycotoxin Poisonous substance produced by fungi. View more via ChEBI Ontology ChEBI Ontology Outgoing cichorine (CHEBI:64977) has role mycotoxin (CHEBI:25442) cichorine (CHEBI:64977) is a isoindoles (CHEBI:24897) cichorine (CHEBI:64977) is a phenols (CHEBI:33853) IUPAC Name 6-hydroxy-4-methoxy-5-methyl-2,3-dihydro-1H-isoindol-1-one Synonym Source Cichorine KEGG COMPOUND Manual Xrefs Databases C00002325 KNApSAcK C10581 KEGG COMPOUND View more database links Registry Numbers Types Sources 114090-43-6 CAS Registry Number KEGG COMPOUND 5521375 Reaxys Registry Number Reaxys Citations Types Sources 16010365 PubMed citation Europe PMC 22510154 PubMed citation Europe PMC Last Modified 28 July 2014