| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:58 UTC |
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| Update Date | 2025-03-25 00:57:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222107 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H13NO2 |
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| Molecular Mass | 227.0946 |
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| SMILES | c1ccc(Nc2cccc3c2OCCO3)cc1 |
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| InChI Key | ARMOEJJGOKUSMG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzodioxanes |
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| Subclass | benzo-1,4-dioxanes |
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| Direct Parent | benzo-1,4-dioxanes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersbenzene and substituted derivativeshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundspara dioxinssecondary amines |
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| Substituents | benzo-1,4-dioxanemonocyclic benzene moietyetheralkyl aryl ethersecondary amineoxacycleorganic oxygen compoundpara-dioxinaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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