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CHEBI:67934 - ophioglonol

ChEBI IDCHEBI:67934
ChEBI Nameophioglonol
Stars
DefinitionA hydroxy homoflavonoid that is 2-phenyl-4H-chromen-4-one substituted by hydroxy groups at positions 5, 7, 3' and 4' and a hydroxymethyl group at position 3. It is isolated from the whole plant of Ophioglossum pedunculosum.
Last Modified9 January 2014
DownloadsMolfile
FormulaC16H12O7
Net Charge0
Average Mass316.265
Monoisotopic Mass316.05830
SMILESO=c1c(CO)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
InChIInChI=1S/C16H12O7/c17-6-9-15(22)14-12(21)4-8(18)5-13(14)23-16(9)7-1-2-10(19)11(20)3-7/h1-5,17-21H,6H2
InChIKeyNWYYMLNNXGJOKK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ophioglossum pedunculosum (ncbitaxon:60874) whole plant (BTO:0001461) PubMed (21401115) 75% EtOH extract of dried whole plant
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
ophioglonol (CHEBI:67934) has role plant metabolite (CHEBI:76924)
ophioglonol (CHEBI:67934) is a hydroxy homoflavonoid (CHEBI:76405)
Incoming Relation(s)
ophioglonol 4'-O-β-D-glucopyranoside (CHEBI:67935) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside A (CHEBI:67873) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside B (CHEBI:67874) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside C (CHEBI:67875) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside D (CHEBI:67876) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside E (CHEBI:67877) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside F (CHEBI:67878) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside G (CHEBI:67879) has functional parent ophioglonol (CHEBI:67934)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-(hydroxymethyl)-4H-chromen-4-one
Registry NumbersSources
Reaxys:15768997Reaxys
Citations