CHEBI:67877 - pedunculosumoside E

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ChEBI Name pedunculosumoside E
ChEBI ID CHEBI:67877
Definition A homoflavonoid glycoside that is ophioglonol attached to a 2-O-(β-D-glucopyranosyl)-β-D-glucopyranosyl and β-D-glucopyranosyl residues at positions 7 and 4ʼ respectively via glycosidic linkages. 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 C34H42O22
Net Charge 0
Average Mass 802.68410
Monoisotopic Mass 802.21677
InChI InChI=1S/C34H42O22/c35-6-12-21(41)20-14(40)4-11(50-34-31(27(47)24(44)19(9-38)55-34)56-33-29(49)26(46)23(43)18(8-37)54-33)5-16(20)51-30(12)10-1-2-15(13(39)3-10)52-32-28(48)25(45)22(42)17(7-36)53-32/h1-5,17-19,22-29,31-40,42-49H,6-9H2/t17-,18-,19-,22-,23-,24-,25+,26+,27+,28-,29-,31-,32-,33+,34-/m1/s1
InChIKey MGXHVYURWVASGT-JGKQFCEOSA-N
SMILES OC[C@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)oc(-c3ccc(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)c(O)c3)c(CO)c4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
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.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pedunculosumoside E (CHEBI:67877) has functional parent ophioglonol (CHEBI:67934)
pedunculosumoside E (CHEBI:67877) has role metabolite (CHEBI:25212)
pedunculosumoside E (CHEBI:67877) has role plant metabolite (CHEBI:76924)
pedunculosumoside E (CHEBI:67877) is a β-D-glucoside (CHEBI:22798)
pedunculosumoside E (CHEBI:67877) is a homoflavonoid glycoside (CHEBI:76404)
pedunculosumoside E (CHEBI:67877) is a hydroxy homoflavonoid (CHEBI:76405)
IUPAC Name
2-[4-(β-D-glucopyranosyloxy)-3-hydroxyphenyl]-5-hydroxy-3-(hydroxymethyl)-4-oxo-4H-chromen-7-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside
Synonym Source
ophioglonol 7-O-β-D-glucopyranosyl-(1→2)-β-D-glucopyranosyl-4ʼ-O-β-D-glucopyranoside ChEBI
Registry Number Type Source
21523328 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21401115 PubMed citation Europe PMC
Last Modified
25 November 2013