CHEBI:177886 - sesterorbiculene

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ChEBI Name sesterorbiculene
ChEBI ID CHEBI:177886
Definition A sesterterpene that is produced by several fungal chimeric terpene synthases (PTTS009, PTTS037 and PTTS054).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Tereza Calounova
Supplier Information
Download Molfile XML SDF
Formula C25H40
Net Charge 0
Average Mass 340.595
Monoisotopic Mass 340.31300
InChI InChI=1S/C25H40/c1-19(2)23-16-18-25(6)17-15-22(5)12-8-10-20(3)9-7-11-21(4)13-14-24(23)25/h7,10-11,13,15,19,23-24H,8-9,12,14,16-18H2,1-6H3/b11-7+,20-10+,21-13+,22-15+/t23-,24+,25+/m0/s1
InChIKey HNQNDSZTKGSDTD-ZCDAFREASA-N
SMILES [H][C@]12C\C=C(/C)\C=C\C\C(C)=C\CC\C(C)=C\C[C@]1(C)CC[C@H]2C(C)C
Metabolite of Species Details
Colletotrichum incanum (NCBI:txid1573173) See: PubMed
Colletotrichum gloeosporioides (NCBI:txid474922) See: PubMed
Colletotrichum orbiculare (NCBI:txid5465) See: PubMed
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sesterorbiculene (CHEBI:177886) has role fungal metabolite (CHEBI:76946)
sesterorbiculene (CHEBI:177886) is a carbobicyclic compound (CHEBI:36785)
sesterorbiculene (CHEBI:177886) is a polycyclic olefin (CHEBI:35714)
sesterorbiculene (CHEBI:177886) is a sesterterpene (CHEBI:35192)
IUPAC Name
(1S,3aS,5E,9E,12E,14E,16aR)-3a,6,10,14-tetramethyl-1-(propan-2-yl)-1,2,3,3a,4,7,8,11,16,16a-decahydrocyclopenta[15]annulene
Synonym Source
(−)-sesterorbiculene ChEBI
Citation Waiting for Citations Type Source
34257153 PubMed citation SUBMITTER
Last Modified
18 August 2021