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CHEBI:132348 - triptonoterpene

ChEBI IDCHEBI:132348
ChEBI Nametriptonoterpene
Stars
DefinitionAn abietane diterpenoid that is abieta-8(14),9(11),12-triene substituted at positions 3 and 14 respectively by oxo and hydroxy groups. It is found in Tripterygium wilfordii.
Last Modified24 October 2016
Submitterliuqingping
DownloadsMolfile
FormulaC20H28O2
Net Charge0
Average Mass300.442
Monoisotopic Mass300.20893
SMILES[H][C@@]12CCc3c(ccc(C(C)C)c3O)[C@@]1(C)CCC(=O)C2(C)C
InChIInChI=1S/C20H28O2/c1-12(2)13-6-8-15-14(18(13)22)7-9-16-19(3,4)17(21)10-11-20(15,16)5/h6,8,12,16,22H,7,9-11H2,1-5H3/t16-,20+/m0/s1
InChIKeyWENIWZBFJBCNNG-OXJNMPFZSA-N
Species of MetaboliteComponentSourceComments
Tripterygium wilfordii (ncbitaxon:458696) - PubMed (17265278)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
triptonoterpene (CHEBI:132348) has role plant metabolite (CHEBI:76924)
triptonoterpene (CHEBI:132348) is a abietane diterpenoid (CHEBI:36762)
triptonoterpene (CHEBI:132348) is a carbotricyclic compound (CHEBI:38032)
triptonoterpene (CHEBI:132348) is a cyclic terpene ketone (CHEBI:36130)
triptonoterpene (CHEBI:132348) is a phenols (CHEBI:33853)
triptonoterpene (CHEBI:132348) is a tricyclic diterpenoid (CHEBI:79084)
IUPAC Name 
14-hydroxyabieta-8(14),9(11),12-trien-3-one
Manual XrefsDatabases
C00035772KNApSAcK
Registry NumbersSources
Reaxys:7432793Reaxys
CAS:99694-87-8KNApSAcK
Citations