CHEBI:138247 - cycloaraneosene

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ChEBI Name cycloaraneosene
Definition A diterpene that has a dicyclopenta[a,d]cyclooctane skeleton containing a double bond at the 6a-7 position and which is substituted by methyl groups at positions 1 and 9a, a methylene group at position 4 and an isopropyl group at position 7 (the 1R,3aR,9aS,10aR isomer). A precursor for sordaricin, the aglycone of sodarin found in Sordaria araneosa.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C20H32
Net Charge 0
Average Mass 272.469
Monoisotopic Mass 272.25040
InChI InChI=1S/C20H32/c1-13(2)16-10-11-20(5)12-18-15(4)6-8-17(18)14(3)7-9-19(16)20/h13,15,17-18H,3,6-12H2,1-2,4-5H3/t15-,17+,18-,20+/m1/s1
SMILES [C@@]12(C[C@]3([C@](C(CCC1=C(CC2)C(C)C)=C)(CC[C@H]3C)[H])[H])C
Metabolite of Species Details
Sordaria araneosa (NCBI:txid573841) See: Kato, J. Chem. Soc., Chem. Commun., 1993, 1002
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 cycloaraneosene (CHEBI:138247) has role fungal metabolite (CHEBI:76946)
cycloaraneosene (CHEBI:138247) is a diterpene (CHEBI:35190)
cycloaraneosene (CHEBI:138247) is a olefinic compound (CHEBI:78840)
cycloaraneosene (CHEBI:138247) is a organic tricyclic compound (CHEBI:51959)
Synonym Source
cycloaraneosene UniProt
Manual Xrefs Databases
C00000507 KNApSAcK
CPD-20446 MetaCyc
View more database links
Registry Number Type Source
110990-41-5 CAS Registry Number KNApSAcK
Citations Waiting for Citations Types Sources
26836448 PubMed citation Europe PMC
27072286 PubMed citation SUBMITTER
Last Modified
08 September 2017