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CHEBI:193158 - talarodiene

ChEBI IDCHEBI:193158
ChEBI Nametalarodiene
Stars
DefinitionA diterpene that is produced by a cryptic type I diterpene synthase in marine-derived fungus Aspergillus flavipes.
Last Modified10 October 2022
SubmitterTereza Calounova
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]12CC[C@H](C)[C@]1([H])C[C@@]1(C)CCC(C)(C)C=C1C/C=C\2C
InChIInChI=1S/C20H32/c1-14-6-8-16-12-19(3,4)10-11-20(16,5)13-18-15(2)7-9-17(14)18/h6,12,15,17-18H,7-11,13H2,1-5H3/b14-6-/t15-,17-,18-,20+/m0/s1
InChIKeyXTOGEKDHHWZDDZ-JAMRKFNNSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavipes (ncbitaxon:41900) - PubMed (36126322) Strain: CNL-338
Roles Classification
Biological Roles:
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
Aspergillus metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
ChEBI Ontology
Outgoing Relation(s)
talarodiene (CHEBI:193158) has role Aspergillus metabolite (CHEBI:76956)
talarodiene (CHEBI:193158) has role marine metabolite (CHEBI:76507)
talarodiene (CHEBI:193158) is a carbotricyclic compound (CHEBI:38032)
talarodiene (CHEBI:193158) is a diterpene (CHEBI:35190)
IUPAC Name 
(1S,3aR,4Z,10aR,11aS)-1,4,8,8,10a-pentamethyl-2,3,3a,6,8,9,10,10a,11,11a-decahydro-1H-benzo[a]cyclopenta[d][8]annulene
UniProt Name  Source
talarodieneUniProt
Citations