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CHEBI:192983 - ent-bonnadiene

ChEBI IDCHEBI:192983
ChEBI Nameent-bonnadiene
Stars
ASCII Nameent-bonnadiene
DefinitionA diterpene produced by a bacterial diterpene synthase from Chryseobacterium wanjuense.
Last Modified15 February 2024
SubmitterTereza Calounova
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@]12C=C(C)CC[C@@]13C(=C(C)CC[C@H]2C(C)C)CC[C@@H]3C
InChIInChI=1S/C20H32/c1-13(2)17-8-6-15(4)18-9-7-16(5)20(18)11-10-14(3)12-19(17)20/h12-13,16-17,19H,6-11H2,1-5H3/t16-,17-,19+,20+/m0/s1
InChIKeyQKYMGWUTPNTJDU-RAUXBKROSA-N
Species of MetaboliteComponentSourceComments
Chryseobacterium wanjuense (ncbitaxon:356305) - PubMed (32342621) Strain: DSM 17724
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
ent-bonnadiene (CHEBI:192983) has role bacterial metabolite (CHEBI:76969)
ent-bonnadiene (CHEBI:192983) is a carbotricyclic compound (CHEBI:38032)
ent-bonnadiene (CHEBI:192983) is a diterpene (CHEBI:35190)
ent-bonnadiene (CHEBI:192983) is a polycyclic olefin (CHEBI:35714)
IUPAC Name 
(3S,3aS,7aS,8S)-3,6,11-trimethyl-8-(propan-2-yl)-2,3,4,5,7a,8,9,10-octahydro-1H-benzo[d]azulene
Citations