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CHEBI:229569 - subrutilene C

ChEBI IDCHEBI:229569
ChEBI Namesubrutilene C
Stars
DefinitionA sesterterpene produced in the bacterium Streptomyces subrutilus.
Last Modified12 February 2024
SubmitterMartin Engst
DownloadsMolfile
FormulaC25H40
Net Charge0
Average Mass340.595
Monoisotopic Mass340.31300
SMILES[H][C@]12C[C@]3(C)CC=C[C@]3(C)[C@@]1([H])C[C@@]1(C)CC[C@]3(C)CC[C@H](C(C)C)[C@@]3([H])[C@@]12[H]
InChIInChI=1S/C25H40/c1-16(2)17-8-11-22(3)12-13-23(4)15-19-18(21(23)20(17)22)14-24(5)9-7-10-25(19,24)6/h7,10,16-21H,8-9,11-15H2,1-6H3/t17-,18+,19+,20+,21+,22+,23-,24+,25-/m1/s1
InChIKeyNEVDTAYPHCQIAF-ZEIVWLNQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces subrutilus (ncbitaxon:36818) - PubMed (37846897)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
subrutilene C (CHEBI:229569) has role bacterial metabolite (CHEBI:76969)
subrutilene C (CHEBI:229569) is a carbopentacyclic compound (CHEBI:177356)
subrutilene C (CHEBI:229569) is a polycyclic olefin (CHEBI:35714)
subrutilene C (CHEBI:229569) is a sesterterpene (CHEBI:35192)
IUPAC Name 
(1R,3aS,5aR,6aS,6bR,9aS,10aS,10bS,10cS)-3a,5a,6b,9a-tetramethyl-1-(propan-2-yl)-1,2,3,3a,4,5,5a,6,6a,6b,9,9a,10,10a,10b,10c-hexadecahydropentaleno[2,1-a]-as-indacene
Citations