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CHEBI:67534 - terprenin

ChEBI IDCHEBI:67534
ChEBI Nameterprenin
Stars
DefinitionA para-terphenyl that is 1,1':4',1''-terphenyl substituted by methoxy groups at positions 3' and 6', hydroxy groups at positions 2', 3 and 4'' and a prenyloxy group at position 4. It has been isolated from Aspergillus taichungensis.
Last Modified13 January 2014
DownloadsMolfile
FormulaC25H26O6
Net Charge0
Average Mass422.477
Monoisotopic Mass422.17294
SMILESCOc1cc(-c2ccc(O)cc2)c(OC)c(O)c1-c1ccc(OCC=C(C)C)c(O)c1
InChIInChI=1S/C25H26O6/c1-15(2)11-12-31-21-10-7-17(13-20(21)27)23-22(29-3)14-19(25(30-4)24(23)28)16-5-8-18(26)9-6-16/h5-11,13-14,26-28H,12H2,1-4H3
InChIKeyXPNTUFZVLSDQBO-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)
terprenin (CHEBI:67534) has role Aspergillus metabolite (CHEBI:76956)
terprenin (CHEBI:67534) is a para-terphenyl (CHEBI:75874)
terprenin (CHEBI:67534) is a dimethoxybenzene (CHEBI:51681)
terprenin (CHEBI:67534) is a phenols (CHEBI:33853)
IUPAC Name 
3',6'-dimethoxy-4-[(3-methylbut-2-en-1-yl)oxy]-1,1':4',1''-terphenyl-2',3,4''-triol
Registry NumbersSources
Reaxys:8017093Reaxys
Citations