CHEBI:68218 - aspergillusene A

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ChEBI Name aspergillusene A ChEBI ID CHEBI:68218 Definition A sesquiterpenoid that is phenol substituted by a hydroxymethyl group at position 5 and a (2E)-6-methylhept-2-en-2-yl group at position 2. An Aspergillus metabolite isolated from the sea fan derived fungus Aspergillus sydowii. 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 C15H22O2 Net Charge 0 Average Mass 234.33400 Monoisotopic Mass 234.16198 InChI InChI=1S/C15H22O2/c1-11(2)5-4-6-12(3)14-8-7-13(10-16)9-15(14)17/h6-9,11,16-17H,4-5,10H2,1-3H3/b12-6+ InChIKey NWPUHDAIOGMKFI-WUXMJOGZSA-N SMILES CC(C)CC\C=C(/C)c1ccc(CO)cc1O Metabolite of Species Details Aspergillus sydowii (NCBI:txid75750) Ethyl acetate extract of culture broth, fungus isolated from a sea fan, Annella sp. of strain PSU F154 See: PubMed Roles Classification Biological Role(s): Aspergillus metabolite Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus . View more via ChEBI Ontology ChEBI Ontology Outgoing aspergillusene A (CHEBI:68218) has role Aspergillus metabolite (CHEBI:76956) aspergillusene A (CHEBI:68218) is a benzyl alcohols (CHEBI:22743) aspergillusene A (CHEBI:68218) is a phenols (CHEBI:33853) aspergillusene A (CHEBI:68218) is a sesquiterpenoid (CHEBI:26658) IUPAC Name 5-(hydroxymethyl)-2-[(2E)-6-methylhept-2-en-2-yl]phenol Synonym Source (E)-5-(hydroxymethyl)-2-(6ʼ-methylhept-2ʼ-en-2ʼ-yl)phenol ChEBI Registry Number Type Source 21708354 Reaxys Registry Number Reaxys Citation Type Source 21718031 PubMed citation Europe PMC Last Modified 13 January 2014