CHEBI:228363 - subrutilane

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ChEBI Name subrutilane
ChEBI ID CHEBI:228363
Definition A sesterterpene produced by subrutilane synthase from the bacterium Streptomyces subrutilus.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Milana Perkovic
Supplier Information
Download Molfile XML SDF
Formula C25H40
Net Charge 0
Average Mass 340.595
Monoisotopic Mass 340.31300
InChI InChI=1S/C25H40/c1-14(2)15-7-8-22(3)9-10-23(4)13-19-16(21(23)20(15)22)12-24(5)17-11-18(17)25(19,24)6/h14-21H,7-13H2,1-6H3/t15-,16+,17+,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1
InChIKey MANXCPMBJHNYLY-AZGYBJRYSA-N
SMILES [H][C@]12C[C@@]1([H])[C@]1(C)[C@@]3([H])C[C@@]4(C)CC[C@]5(C)CC[C@H](C(C)C)[C@@]5([H])[C@]4([H])[C@@]3([H])C[C@]21C
Metabolite of Species Details
Streptomyces subrutilus (NCBI:txid36818) See: PubMed
Roles Classification
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing subrutilane (CHEBI:228363) has role bacterial metabolite (CHEBI:76969)
subrutilane (CHEBI:228363) is a carbopolycyclic compound (CHEBI:35294)
subrutilane (CHEBI:228363) is a sesterterpene (CHEBI:35192)
IUPAC Name
(1R,3aS,5aR,6aS,6bS,6cR,7aS,7bR,8aS,8bS,8cS)-3a,5a,6b,7b-tetramethyl-1-(propan-2-yl)octadecahydrocyclopropa[3',4']cyclobuta[1',2':3,4]cyclopenta[1,2-a]-as-indacene
Citation Waiting for Citations Type Source
37846897 PubMed citation Europe PMC
Last Modified
02 January 2024