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CHEBI:67936 - ophioglonin 7-O-β-D-glucopyranoside

ChEBI IDCHEBI:67936
ChEBI Nameophioglonin 7-O-β-D-glucopyranoside
Stars
ASCII Nameophioglonin 7-O-beta-D-glucopyranoside
DefinitionA homoflavonoid glycoside that is ophioglonin attached to a β-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It has been isolated from Ophioglossum pedunculosum.
Last Modified25 November 2013
DownloadsMolfile
FormulaC22H20O12
Net Charge0
Average Mass476.390
Monoisotopic Mass476.09548
SMILESO=c1c2c(oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(O)c13)-c1ccc(O)c(O)c1CO2
InChIInChI=1S/C22H20O12/c23-5-13-16(27)18(29)19(30)22(34-13)32-7-3-11(25)14-12(4-7)33-20-8-1-2-10(24)15(26)9(8)6-31-21(20)17(14)28/h1-4,13,16,18-19,22-27,29-30H,5-6H2/t13-,16-,18+,19-,22-/m1/s1
InChIKeyZBYBUYZJKQWRDO-FSFQXNNFSA-N
Species of MetaboliteComponentSourceComments
Ophioglossum pedunculosum (ncbitaxon:60874) whole plant (BTO:0001461) PubMed (21401115) 75% EtOH extract of dried whole plant
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)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) has functional parent ophioglonin (CHEBI:66823)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) has role metabolite (CHEBI:25212)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) has role plant metabolite (CHEBI:76924)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) is a homoflavonoid glycoside (CHEBI:76404)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) is a hydroxy homoflavonoid (CHEBI:76405)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) is a monosaccharide derivative (CHEBI:63367)
ophioglonin 7-O-β-D-glucopyranoside (CHEBI:67936) is a β-D-glucoside (CHEBI:22798)
IUPAC Name 
3,4,8-trihydroxy-7-oxo-5,7-dihydroisochromeno[4,3-b]chromen-10-yl β-D-glucopyranoside
Registry NumbersSources
Reaxys:15769001Reaxys
Citations