ophioglonol (CHEBI:67934)

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ChEBI Name	ophioglonol

ChEBI ID	CHEBI:67934

Definition	A hydroxy homoflavonoid that is 2-phenyl-4H-chromen-4-one substituted by hydroxy groups at positions 5, 7, 3ʼ and 4ʼ and a hydroxymethyl group at position 3. It is isolated from the whole plant of Ophioglossum pedunculosum.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C16H12O7

Net Charge

Average Mass

316.26230

Monoisotopic Mass

316.05830

InChI

InChI=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

InChIKey

NWYYMLNNXGJOKK-UHFFFAOYSA-N

SMILES

OCc1c(oc2cc(O)cc(O)c2c1=O)-c1ccc(O)c(O)c1

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.

ChEBI Ontology
Outgoing	ophioglonol (CHEBI:67934) has role plant metabolite (CHEBI:76924) ophioglonol (CHEBI:67934) is a hydroxy homoflavonoid (CHEBI:76405)

Incoming	ophioglonol 4ʼ-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 Number	Type	Source
15768997	Reaxys Registry Number	Reaxys

Last Modified

09 January 2014