Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:43:55 UTC |
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Update Date | 2025-03-21 17:59:55 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00024096 |
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Frequency | 162.2 |
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Structure | |
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Chemical Formula | C21H24O12 |
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Molecular Mass | 468.1268 |
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SMILES | OCC1OC(Oc2cc(C3Oc4cc(O)cc(O)c4CC3O)cc(O)c2O)C(O)C(O)C1O |
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InChI Key | UTUVTQPYOKGMAA-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | phenylpropanoids and polyketides |
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Class | flavonoids |
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Subclass | flavonoid glycosides |
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Direct Parent | flavonoid o-glycosides |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids3'-hydroxyflavonoids3-hydroxyflavonoids4'-hydroxyflavonoids5-hydroxyflavonoids7-hydroxyflavonoidsacetalsalkyl aryl ethersepigallocatechinshydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanesphenol ethersphenoxy compoundsprimary alcoholssecondary alcohols |
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Substituents | phenol ethermonocyclic benzene moiety3-hydroxyflavonoidether1-benzopyranflavan1-hydroxy-2-unsubstituted benzenoidmonosaccharidealkyl aryl ethersaccharideacetalaromatic heteropolycyclic compoundchromanecatechinflavonoid-3p-o-glycosideoxaneflavan-3-olprimary alcoholorganoheterocyclic compoundalcoholbenzopyran5-hydroxyflavonoid1-hydroxy-4-unsubstituted benzenoidflavonoid o-glycoside3'-hydroxyflavonoidoxacycleorganic oxygen compound7-hydroxyflavonoidsecondary alcohol4'-hydroxyflavonoidphenolhydrocarbon derivativebenzenoidphenoxy compoundepigallocatechinorganooxygen compound |
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