| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:50 UTC |
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| Update Date | 2025-03-25 00:53:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200898 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H16O3 |
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| Molecular Mass | 256.1099 |
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| SMILES | COc1ccc2c(c1)CC(c1cccc(O)c1)CO2 |
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| InChI Key | BYXGLDSGVOWLLJ-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 | 6-o-methylated isoflavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesbenzene and substituted derivativeshydrocarbon derivativesisoflavansoxacyclic compounds |
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| Substituents | isoflavanphenol ethermonocyclic benzene moietyetherbenzopyran1-benzopyran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidalkyl aryl etheroxacycle6-methoxyisoflavonoid-skeletonorganic oxygen compoundaromatic heteropolycyclic compoundanisolechromanephenolhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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