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CHEBI:67536 - 3-hydroxyterphenyllin

ChEBI IDCHEBI:67536
ChEBI Name3-hydroxyterphenyllin
Stars
DefinitionA para-terphenyl that is the 3-hydroxy derivative of terphenyllin. It has been isolated from Aspergillus taichungensis.
Last Modified13 January 2014
DownloadsMolfile
FormulaC20H18O6
Net Charge0
Average Mass354.358
Monoisotopic Mass354.11034
SMILESCOc1cc(-c2ccc(O)cc2)c(OC)c(O)c1-c1ccc(O)c(O)c1
InChIInChI=1S/C20H18O6/c1-25-17-10-14(11-3-6-13(21)7-4-11)20(26-2)19(24)18(17)12-5-8-15(22)16(23)9-12/h3-10,21-24H,1-2H3
InChIKeyYLSPFNUVVOKJDF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus taichungensis (ncbitaxon:482145) mycelium (BTO:0001436) PubMed (21486068) EtOAc extract of fungal strain was isolated from root soil of Acrostichum aureum (mangrove plant) Strain: ZHN 7-07
Roles Classification
Biological Role:
Aspergillus metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
ChEBI Ontology
Outgoing Relation(s)
3-hydroxyterphenyllin (CHEBI:67536) has functional parent terphenyllin (CHEBI:67537)
3-hydroxyterphenyllin (CHEBI:67536) has role Aspergillus metabolite (CHEBI:76956)
3-hydroxyterphenyllin (CHEBI:67536) is a para-terphenyl (CHEBI:75874)
3-hydroxyterphenyllin (CHEBI:67536) is a catechols (CHEBI:33566)
3-hydroxyterphenyllin (CHEBI:67536) is a dimethoxybenzene (CHEBI:51681)
Incoming Relation(s)
4''-dehydro-3-hydroxyterphenyllin (CHEBI:67529) has functional parent 3-hydroxyterphenyllin (CHEBI:67536)
IUPAC Name 
3',6'-dimethoxy-1,1':4',1''-terphenyl-2',3,4,4''-tetrol
Registry NumbersSources
Reaxys:2185381Reaxys
CAS:66163-76-6ChemIDplus
Citations