EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:68290 - cycloinumakiol

ChEBI IDCHEBI:68290
ChEBI Namecycloinumakiol
Stars
DefinitionAn abietane diterpenoid that is podocarpa-8,11,13-triene substituted by a propan-2-yl group at position 14 at an epoxy group across positions 11 and 17. It is isolated from Podocarpus latifolius.
Last Modified21 August 2013
DownloadsMolfile
FormulaC20H28O
Net Charge0
Average Mass284.443
Monoisotopic Mass284.21402
SMILES[H][C@@]12CCc3c(C(C)C)ccc4c3[C@]1(CCCC2(C)C)CO4
InChIInChI=1S/C20H28O/c1-13(2)14-6-8-16-18-15(14)7-9-17-19(3,4)10-5-11-20(17,18)12-21-16/h6,8,13,17H,5,7,9-12H2,1-4H3/t17-,20+/m0/s1
InChIKeyXNNWEJWWBGSSMR-FXAWDEMLSA-N
Species of MetaboliteComponentSourceComments
Podocarpus latifolius (ncbitaxon:120620) root (BTO:0001188) PubMed (21306129) Previous component: root bark; CH2Cl2-MeOH(1:1) extract of dried, ground root bark
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
cycloinumakiol (CHEBI:68290) has role metabolite (CHEBI:25212)
cycloinumakiol (CHEBI:68290) is a abietane diterpenoid (CHEBI:36762)
cycloinumakiol (CHEBI:68290) is a cyclic ether (CHEBI:37407)
cycloinumakiol (CHEBI:68290) is a organic heterotetracyclic compound (CHEBI:38163)
IUPAC Name 
14-(propan-2-yl)-11,17-epoxypodocarpa-8,11,13-triene
Registry NumbersSources
Reaxys:21394579Reaxys
Citations