CHEBI:67876 - pedunculosumoside D

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ChEBI Name pedunculosumoside D
ChEBI ID CHEBI:67876
Definition A homoflavonoid glycoside that is 5ʼ-prenylophioglonol attached to a β-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It has been isolated from the whole plants of Ophioglossum pedunculosum.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H30O12
Net Charge 0
Average Mass 546.51990
Monoisotopic Mass 546.17373
InChI InChI=1S/C27H30O12/c1-11(2)3-4-12-5-13(6-17(31)21(12)32)26-15(9-28)22(33)20-16(30)7-14(8-18(20)38-26)37-27-25(36)24(35)23(34)19(10-29)39-27/h3,5-8,19,23-25,27-32,34-36H,4,9-10H2,1-2H3/t19-,23-,24+,25-,27-/m1/s1
InChIKey TTYVGHVGKPQQDZ-ZOTWRPDGSA-N
SMILES CC(C)=CCc1cc(cc(O)c1O)-c1oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2c(=O)c1CO
Metabolite of Species Details
Ophioglossum pedunculosum (NCBI:txid60874) Found in whole plant (BTO:0001461). 75% EtOH extract of dried whole plant See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pedunculosumoside D (CHEBI:67876) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside D (CHEBI:67876) has role plant metabolite (CHEBI:76924)
pedunculosumoside D (CHEBI:67876) is a β-D-glucoside (CHEBI:22798)
pedunculosumoside D (CHEBI:67876) is a homoflavonoid glycoside (CHEBI:76404)
pedunculosumoside D (CHEBI:67876) is a hydroxy homoflavonoid (CHEBI:76405)
pedunculosumoside D (CHEBI:67876) is a monosaccharide derivative (CHEBI:63367)
IUPAC Name
2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5-hydroxy-3-(hydroxymethyl)-4-oxo-4H-chromen-7-yl β-D-glucopyranoside
Synonym Source
5ʼ-(3-methyl-2-buten-1-yl)ophioglonol 7-O-β-D-glucopyranoside ChEBI
Registry Number Type Source
21523323 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21401115 PubMed citation Europe PMC
Last Modified
09 January 2014