EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:70081 - (+)-aR,11S-Myricanol

ChEBI IDCHEBI:70081
ChEBI Name(+)-aR,11S-Myricanol
Stars
DefinitionA natural product found in Myrica cerifera.
Last Modified22 September 2014
DownloadsMolfile
FormulaC21H26O5
Net Charge0
Average Mass358.434
Monoisotopic Mass358.17802
SMILESCOc1c(O)c2cc(c1OC)-c1cc(ccc1O)CC[C@@H](O)CCCC2
InChIInChI=1S/C21H26O5/c1-25-20-17-12-14(19(24)21(20)26-2)5-3-4-6-15(22)9-7-13-8-10-18(23)16(17)11-13/h8,10-12,15,22-24H,3-7,9H2,1-2H3/t15-/m0/s1
InChIKeySBGBAZQAEOWGFT-HNNXBMFYSA-N
Species of MetaboliteComponentSourceComments
Myrica cerifera (ncbitaxon:3510) root (BTO:0001188) PubMed (21141876) Previous component: root bark; Toluene extract of raw-bayberry root-bark powder
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)
(+)-aR,11S-Myricanol (CHEBI:70081) has role metabolite (CHEBI:25212)
(+)-aR,11S-Myricanol (CHEBI:70081) is a biphenyls (CHEBI:22888)
Synonym  Source
(9S)-16,17-Dimethoxytricyclo[12.3.1.1(2,6)]nonadeca1(18),2(19),3,5,14,16-hexaene-3,9,15-triolChEBI
Citations