CHEBI:67537 - terphenyllin

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ChEBI Name terphenyllin ChEBI ID CHEBI:67537 Definition A para-terphenyl that is 1,1ʼ:4ʼ,1ʼʼ-terphenyl substituted by methoxy groups at positions 3' and 6' and hydroxy groups at positions 2ʼ, 4 and 4ʼʼ. It has been isolated from Aspergillus taichungensis. 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 C20H18O5 Net Charge 0 Average Mass 338.35390 Monoisotopic Mass 338.11542 InChI InChI=1S/C20H18O5/c1-24-17-11-16(12-3-7-14(21)8-4-12)20(25-2)19(23)18(17)13-5-9-15(22)10-6-13/h3-11,21-23H,1-2H3 InChIKey YNEMPXKRLPZFAX-UHFFFAOYSA-N SMILES COc1cc(-c2ccc(O)cc2)c(OC)c(O)c1-c1ccc(O)cc1 Metabolite of Species Details Aspergillus taichungensis (NCBI:txid482145) Found in mycelium (BTO:0001436). EtOAc extract of fungal strain was isolated from root soil of Acrostichum aureum (mangrove plant) of strain ZHN 7-07 See: PubMed Roles Classification Biological Role(s): mycotoxin Poisonous substance produced by fungi. Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . View more via ChEBI Ontology ChEBI Ontology Outgoing terphenyllin (CHEBI:67537) has role Aspergillus metabolite (CHEBI:76956) terphenyllin (CHEBI:67537) has role mycotoxin (CHEBI:25442) terphenyllin (CHEBI:67537) is a para-terphenyl (CHEBI:75874) terphenyllin (CHEBI:67537) is a dimethoxybenzene (CHEBI:51681) terphenyllin (CHEBI:67537) is a phenols (CHEBI:33853) Incoming 3,3ʼʼ-dihydroxy-6ʼ-O-desmethylterphenyllin (CHEBI:67401) has functional parent terphenyllin (CHEBI:67537) 3,3ʼʼ-dihydroxyterphenyllin (CHEBI:67538) has functional parent terphenyllin (CHEBI:67537) 3-hydroxy-6ʼ-O-desmethylterphenyllin (CHEBI:67400) has functional parent terphenyllin (CHEBI:67537) 3-hydroxyterphenyllin (CHEBI:67536) has functional parent terphenyllin (CHEBI:67537) 4ʼʼ-deoxyterphenyllin (CHEBI:67535) has functional parent terphenyllin (CHEBI:67537) 6ʼ-O-desmethylterphenyllin (CHEBI:67399) has functional parent terphenyllin (CHEBI:67537) IUPAC Name 3ʼ,6ʼ-dimethoxy-1,1ʼ:4ʼ,1ʼʼ-terphenyl-2ʼ,4,4ʼʼ-triol Registry Numbers Types Sources 2013472 Reaxys Registry Number Reaxys 52452-60-5 CAS Registry Number ChemIDplus Citations Types Sources 1011375 PubMed citation Europe PMC 1150533 PubMed citation Europe PMC 21486068 PubMed citation Europe PMC 22196792 PubMed citation Europe PMC 613931 PubMed citation Europe PMC Last Modified 13 January 2014