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CHEBI:138965 - 11,20-dihydroxyferruginol

ChEBI IDCHEBI:138965
ChEBI Name11,20-dihydroxyferruginol
Stars
DefinitionAn abietane diterpenoid that is ferruginol in which a hydrogen of the bridgehead methyl group and the hydrogen ortho to the phenolic hydroxy group have both been replaced by hydroxy groups.
Last Modified9 January 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC20H30O3
Net Charge0
Average Mass318.457
Monoisotopic Mass318.21949
SMILES[H][C@@]12CCc3cc(C(C)C)c(O)c(O)c3[C@@]1(CO)CCCC2(C)C
InChIInChI=1S/C20H30O3/c1-12(2)14-10-13-6-7-15-19(3,4)8-5-9-20(15,11-21)16(13)18(23)17(14)22/h10,12,15,21-23H,5-9,11H2,1-4H3/t15-,20+/m0/s1
InChIKeyZBPGOZPDUZTLRB-MGPUTAFESA-N
Species of MetaboliteComponentSourceComments
Salvia mellifera (ncbitaxon:392671) aerial part (BTO:0001658) Article (Phytochemistry, 1991, 30(12), 4067-4070)
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)
11,20-dihydroxyferruginol (CHEBI:138965) has functional parent ferruginol (CHEBI:78274)
11,20-dihydroxyferruginol (CHEBI:138965) has role plant metabolite (CHEBI:76924)
11,20-dihydroxyferruginol (CHEBI:138965) is a abietane diterpenoid (CHEBI:36762)
11,20-dihydroxyferruginol (CHEBI:138965) is a carbotricyclic compound (CHEBI:38032)
11,20-dihydroxyferruginol (CHEBI:138965) is a catechols (CHEBI:33566)
11,20-dihydroxyferruginol (CHEBI:138965) is a meroterpenoid (CHEBI:64419)
11,20-dihydroxyferruginol (CHEBI:138965) is a primary alcohol (CHEBI:15734)
Incoming Relation(s)
11,20-dihydroxysugiol (CHEBI:138963) has functional parent 11,20-dihydroxyferruginol (CHEBI:138965)
IUPAC Name 
abieta-8,11,13-triene-11,12,20-triol
UniProt Name  Source
11,20-dihydroxyferruginolUniProt
Manual XrefsDatabases
CPD-20271MetaCyc
Registry NumbersSources
Reaxys:5349789Reaxys
Citations