CHEBI:133757 - fonsecinone C

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ChEBI Name fonsecinone C ChEBI ID CHEBI:133757 Definition A dimeric naphthopyran with formula C32H28O11, originally isolated from Aspergillus niger. Stars This entity has been manually annotated by the ChEBI Team. Submitter Julian Brandl Supplier Information No supplier information found for this compound. Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C32H28O11 Net Charge 0 Average Mass 588.559 Monoisotopic Mass 588.16316 InChI InChI=1S/C32H28O11/c1-13-7-17(33)25-18(34)8-14-9-20(39-4)27(29(41-6)22(14)30(25)42-13)24-16-10-15(38-3)11-21(40-5)23(16)28(36)26-19(35)12-32(2,37)43-31(24)26/h7-11,34,36-37H,12H2,1-6H3 InChIKey XWHLKURAEUPHAB-UHFFFAOYSA-N SMILES C=1(C2=C(C=C(C1)OC)C(=C3C(=C2O)C(CC(O3)(C)O)=O)C=4C(=C5C(=CC4OC)C=C(C6=C5OC(=CC6=O)C)O)OC)OC Metabolite of Species Details Aspergillus fonsecaeus (IF:284301) of strain NRRL67 See: DOI Aspergillus niger ATCC 1015 (NCBI:txid380704) of strain ATCC 11414 See: PubMed Roles Classification Biological Role(s): antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . View more via ChEBI Ontology ChEBI Ontology Outgoing fonsecinone C (CHEBI:133757) has role Aspergillus metabolite (CHEBI:76956) fonsecinone C (CHEBI:133757) has role antibacterial agent (CHEBI:33282) fonsecinone C (CHEBI:133757) is a aromatic ether (CHEBI:35618) fonsecinone C (CHEBI:133757) is a aromatic ketone (CHEBI:76224) fonsecinone C (CHEBI:133757) is a biaryl (CHEBI:64459) fonsecinone C (CHEBI:133757) is a cyclic hemiketal (CHEBI:59780) fonsecinone C (CHEBI:133757) is a cyclic ketone (CHEBI:3992) fonsecinone C (CHEBI:133757) is a naphtho-γ-pyrone (CHEBI:64542) fonsecinone C (CHEBI:133757) is a polyphenol (CHEBI:26195) IUPAC Name 9-(2,5-dihydroxy-6,8-dimethoxy-2-methyl-4-oxo-3,4-dihydro-2H-naphtho[2,3-b]pyran-10-yl)-5-hydroxy-8,10-dimethoxy-2-methyl-4H-naphtho[1,2-b]pyran-4-one Manual Xref Database 90477754 PubChem View more database links Registry Number Type Source 5209914 Reaxys Registry Number Reaxys Citations Last Modified 07 November 2024