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CHEBI:70577 - 6β-hydroxyferruginol

ChEBI IDCHEBI:70577
ChEBI Name6β-hydroxyferruginol
Stars
ASCII Name6beta-hydroxyferruginol
DefinitionA meroterpenoid that is ferruginol substituted by a β-hydroxy group at position 6. It has been isolated from the stem bark of Fraxinus sieboldiana.
Last Modified14 April 2015
DownloadsMolfile
FormulaC20H30O2
Net Charge0
Average Mass302.458
Monoisotopic Mass302.22458
SMILES[H][C@@]12CCc3cc(C(C)C)c(O)cc3[C@@]1(C)C[C@H](O)CC2(C)C
InChIInChI=1S/C20H30O2/c1-12(2)15-8-13-6-7-18-19(3,4)10-14(21)11-20(18,5)16(13)9-17(15)22/h8-9,12,14,18,21-22H,6-7,10-11H2,1-5H3/t14-,18+,20-/m1/s1
InChIKeyPRYXPGFZVGZNBL-HEFCMCLBSA-N
Species of MetaboliteComponentSourceComments
Fraxinus sieboldiana (ncbitaxon:490850) stem (BTO:0001300) PubMed (20961093) Previous component: stem bark; EtOAc soluble fraction of 95% ethanolic extract of air-dried stem bark
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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)
6β-hydroxyferruginol (CHEBI:70577) has functional parent ferruginol (CHEBI:78274)
6β-hydroxyferruginol (CHEBI:70577) has role plant metabolite (CHEBI:76924)
6β-hydroxyferruginol (CHEBI:70577) is a carbotricyclic compound (CHEBI:38032)
6β-hydroxyferruginol (CHEBI:70577) is a meroterpenoid (CHEBI:64419)
6β-hydroxyferruginol (CHEBI:70577) is a phenols (CHEBI:33853)
IUPAC Name 
(2β)-abieta-8,11,13-triene-2,12-diol
Registry NumbersSources
Reaxys:21097458Reaxys
Citations