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CHEBI:69451 - 5''-methoxyhydnocarpin-D

ChEBI IDCHEBI:69451
ChEBI Name5''-methoxyhydnocarpin-D
Stars
DefinitionA flavonolignan isoalted from Mimosa diplotricha.
Last Modified3 August 2014
DownloadsMolfile
FormulaC26H22O10
Net Charge0
Average Mass494.452
Monoisotopic Mass494.12130
SMILESCOc1cc([C@H]2Oc3cc(-c4cc(=O)c5c(O)cc(O)cc5o4)ccc3O[C@@H]2CO)cc(OC)c1O
InChIInChI=1S/C26H22O10/c1-32-21-6-13(7-22(33-2)25(21)31)26-23(11-27)34-17-4-3-12(5-19(17)36-26)18-10-16(30)24-15(29)8-14(28)9-20(24)35-18/h3-10,23,26-29,31H,11H2,1-2H3/t23-,26-/m1/s1
InChIKeyXBXVVTMNRUIPIX-ZEQKJWHPSA-N
Species of MetaboliteComponentSourceComments
Mimosa diplotricha (ncbitaxon:512270) aerial part (BTO:0001658) PubMed (21875046) Ethanolic extract of aerial parts
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)
5''-methoxyhydnocarpin-D (CHEBI:69451) has role plant metabolite (CHEBI:76924)
5''-methoxyhydnocarpin-D (CHEBI:69451) is a benzodioxine (CHEBI:64096)
5''-methoxyhydnocarpin-D (CHEBI:69451) is a dimethoxybenzene (CHEBI:51681)
5''-methoxyhydnocarpin-D (CHEBI:69451) is a flavonolignan (CHEBI:72709)
5''-methoxyhydnocarpin-D (CHEBI:69451) is a polyphenol (CHEBI:26195)
Manual XrefsDatabases
C11162KEGG COMPOUND
Registry NumbersSources
Reaxys:21878434Reaxys
Citations