CHEBI:68720 - chaetochromin C

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ChEBI Name chaetochromin C ChEBI ID CHEBI:68720 Definition A biaryl that is 2,2ʼ,3,3ʼ-tetrahydro-4H,4ʼH-9,9ʼ-bibenzo[g]chromene-4,4ʼ-dione substituted by hydroxy groups at positions 5, 5ʼ, 6, 6ʼ, 8 and 8ʼ and methyl groups at positions 2, 2ʼ and 3 (the 2R,3R stereoisomer). It has been isolated from Chaetomium gracile. Stars This entity has been manually annotated by the ChEBI Team. 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 C29H24O10 Net Charge 0 Average Mass 532.49490 Monoisotopic Mass 532.13695 InChI InChI=1S/C29H24O10/c1-9-4-14(30)25-19(38-9)5-12-21(15(31)7-17(33)23(12)28(25)36)22-13-6-20-26(27(35)10(2)11(3)39-20)29(37)24(13)18(34)8-16(22)32/h5-11,31-34,36-37H,4H2,1-3H3/t9?,10-,11-/m1/s1 InChIKey ZHECJFNKDQXHIW-FHZGLPGMSA-N SMILES CC1CC(=O)c2c(O1)cc1c(c(O)cc(O)c1c2O)-c1c(O)cc(O)c2c(O)c3C(=O)[C@H](C)[C@@H](C)Oc3cc12 Metabolite of Species Details Chaetomium gracile (NCBI:txid47794) See: PubMed Roles Classification Biological Role(s): Chaetomium metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Chaetomium. View more via ChEBI Ontology ChEBI Ontology Outgoing chaetochromin C (CHEBI:68720) has role Chaetomium metabolite (CHEBI:76960) chaetochromin C (CHEBI:68720) is a benzochromenone (CHEBI:64986) chaetochromin C (CHEBI:68720) is a biaryl (CHEBI:64459) chaetochromin C (CHEBI:68720) is a phenols (CHEBI:33853) IUPAC Name (2R,3R)-5,5ʼ,6,6ʼ,8,8ʼ-hexahydroxy-2,2ʼ,3-trimethyl-2,2ʼ,3,3ʼ-tetrahydro-4H,4ʼH-9,9ʼ-bibenzo[g]chromene-4,4ʼ-dione Manual Xref Database 24679261 ChemSpider View more database links Registry Number Type Source 5787447 Reaxys Registry Number Reaxys Citation Type Source 3594673 PubMed citation Europe PMC Last Modified 13 January 2014