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CHEBI:67532 - prenylcandidusin C

ChEBI IDCHEBI:67532
ChEBI Nameprenylcandidusin C
Stars
DefinitionA member of the class of dibenzofurans that is 3,6,9-trimethoxydibenzo[b,d]furan-2-ol substituted by a 4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl substituent at position 3. It has been isolated from Aspergillus taichungensis.
Last Modified13 January 2014
DownloadsMolfile
FormulaC26H26O6
Net Charge0
Average Mass434.488
Monoisotopic Mass434.17294
SMILESCOc1cc2oc3c(OC)c(-c4ccc(O)c(CC=C(C)C)c4)cc(OC)c3c2cc1O
InChIInChI=1S/C26H26O6/c1-14(2)6-7-16-10-15(8-9-19(16)27)17-12-23(30-4)24-18-11-20(28)22(29-3)13-21(18)32-26(24)25(17)31-5/h6,8-13,27-28H,7H2,1-5H3
InChIKeyHWBQSNYBSJLMIS-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 .
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
prenylcandidusin C (CHEBI:67532) has role Aspergillus metabolite (CHEBI:76956)
prenylcandidusin C (CHEBI:67532) has role antineoplastic agent (CHEBI:35610)
prenylcandidusin C (CHEBI:67532) is a aromatic ether (CHEBI:35618)
prenylcandidusin C (CHEBI:67532) is a dibenzofurans (CHEBI:38922)
prenylcandidusin C (CHEBI:67532) is a phenols (CHEBI:33853)
IUPAC Name 
7-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-3,6,9-trimethoxydibenzo[b,d]furan-2-ol
Registry NumbersSources
Reaxys:21577513Reaxys
Citations