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CHEBI:69954 - rel-(1R,3E,7E,11R,12R)-12-Hydroxy-3,7-dolabelladiene

ChEBI IDCHEBI:69954
ChEBI Namerel-(1R,3E,7E,11R,12R)-12-Hydroxy-3,7-dolabelladiene
Stars
DefinitionA natural product found in Dilophus spiralis.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H34O
Net Charge0
Average Mass290.491
Monoisotopic Mass290.26097
SMILES[H][C@@]12CC/C(C)=C/CC/C(C)=C/C[C@@]1(C)CC[C@@]2(O)C(C)C
InChIInChI=1S/C20H34O/c1-15(2)20(21)14-13-19(5)12-11-17(4)8-6-7-16(3)9-10-18(19)20/h7,11,15,18,21H,6,8-10,12-14H2,1-5H3/b16-7+,17-11+/t18-,19+,20-/m1/s1
InChIKeyRVTWKSHZFSEJRD-RGYXUMAVSA-N
Species of MetaboliteComponentSourceComments
Dilophus spiralis (ncbitaxon:499621) - PubMed (21190330) Dichloromethane extract of freeze-dried alga
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)
rel-(1R,3E,7E,11R,12R)-12-Hydroxy-3,7-dolabelladiene (CHEBI:69954) has role metabolite (CHEBI:25212)
rel-(1R,3E,7E,11R,12R)-12-Hydroxy-3,7-dolabelladiene (CHEBI:69954) is a diterpenoid (CHEBI:23849)
Citations