EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:69308 - Leubethanol

ChEBI IDCHEBI:69308
ChEBI NameLeubethanol
Stars
DefinitionA natural product found in Leucophyllum frutescens.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H30O
Net Charge0
Average Mass286.459
Monoisotopic Mass286.22967
SMILES[H][C@@]1([C@@H](C)CCC=C(C)C)CC[C@@H](C)c2c(O)cc(C)cc21
InChIInChI=1S/C20H30O/c1-13(2)7-6-8-15(4)17-10-9-16(5)20-18(17)11-14(3)12-19(20)21/h7,11-12,15-17,21H,6,8-10H2,1-5H3/t15-,16+,17-/m0/s1
InChIKeyWQVJUBFKFCDYDQ-BBWFWOEESA-N
Species of MetaboliteComponentSourceComments
Leucophyllum frutescens (ncbitaxon:86643) root (BTO:0001188) PubMed (21859082) Previous component: root bark; MeOH extract of air-dried and pulverized 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)
Leubethanol (CHEBI:69308) has role metabolite (CHEBI:25212)
Leubethanol (CHEBI:69308) is a diterpenoid (CHEBI:23849)
Synonym  Source
(5S,8R)-3,8-Dimethyl-5-[(2S)-6-methyl-5-hepten-2-yl]-5,6,7,8-tetrahydro-1-naphthalinolChEBI
Citations