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CHEBI:229598 - collinodiene

ChEBI IDCHEBI:229598
ChEBI Namecollinodiene
Stars
DefinitionA diterpene produced by a diterpene synthase from Streptomyces collinus.
Last Modified1 March 2024
SubmitterMartin Engst
DownloadsMolfile
FormulaC20H32
Net Charge0
Average Mass272.476
Monoisotopic Mass272.25040
SMILES[H][C@@]12CC[C@H](C(C)C)[C@@]1(C)C/C=C(/C)C1=CC[C@@H](C)[C@@]1([H])C2
InChIInChI=1S/C20H32/c1-13(2)19-9-7-16-12-18-14(3)6-8-17(18)15(4)10-11-20(16,19)5/h8,10,13-14,16,18-19H,6-7,9,11-12H2,1-5H3/b15-10-/t14-,16+,18-,19-,20+/m1/s1
InChIKeyWWTSDXCBDGZHTK-CKIJUMEXSA-N
Species of MetaboliteComponentSourceComments
Streptomyces collinus (ncbitaxon:42684) - PubMed (37579200)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
collinodiene (CHEBI:229598) has role bacterial metabolite (CHEBI:76969)
collinodiene (CHEBI:229598) is a carbotricyclic compound (CHEBI:38032)
collinodiene (CHEBI:229598) is a diterpene (CHEBI:35190)
collinodiene (CHEBI:229598) is a polycyclic olefin (CHEBI:35714)
IUPAC Name 
(3R,3aS,5Z,9R,9aR,10aS)-3a,6,9-trimethyl-3-(propan-2-yl)-1,2,3,3a,4,8,9,9a,10,10a-decahydrodicyclopenta[a,d][8]annulene
Citations