| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:45:17 UTC |
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| Update Date | 2025-03-21 18:00:26 UTC |
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| HMDB ID | HMDB0038811 |
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| Metabolite Identification |
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| DeepMet ID | DMID00027340 |
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| Name | Alfalone |
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| Frequency | 138.9 |
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| Structure | |
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| Chemical Formula | C17H14O5 |
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| Molecular Mass | 298.0841 |
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| SMILES | COc1ccc(-c2coc3cc(OC)c(O)cc3c2=O)cc1 |
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| InChI Key | CQULNEWSZBPFNL-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 | isoflavonoids |
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| Subclass | o-methylated isoflavonoids |
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| Direct Parent | 7-o-methylisoflavones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisoleschromonesheteroaromatic compoundshydrocarbon derivativesisoflavonesisoflavonoidsmethoxybenzenesorganic oxidesoxacyclic compoundsphenoxy compoundspyranones and derivatives |
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| Substituents | phenol ethermonocyclic benzene moietyether1-benzopyran1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherorganic oxidechromonearomatic heteropolycyclic compoundpyranoneorganoheterocyclic compound7-o-methylisoflavoneisoflavonebenzopyranheteroaromatic compoundmethoxybenzeneoxacycleorganic oxygen compoundpyrananisolehydrocarbon derivativebenzenoidphenoxy compoundorganooxygen compound |
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