| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:06 UTC |
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| Update Date | 2025-03-25 00:58:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233500 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H15NO4 |
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| Molecular Mass | 273.1001 |
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| SMILES | Nc1ccc(O)c2c1C(O)C(c1ccc(O)cc1)CO2 |
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| InChI Key | VNPLJHJOIXFWLS-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 | isoflavans |
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| Direct Parent | isoflavanols |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersbenzene and substituted derivativeshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundsprimary aminessecondary alcohols |
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| Substituents | monocyclic benzene moietyether1-benzopyranisoflavanol1-hydroxy-2-unsubstituted benzenoidalkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundchromaneorganoheterocyclic compoundalcoholbenzopyranoxacycleorganic oxygen compoundsecondary alcoholphenolhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundamineorganooxygen compound |
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