| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:18 UTC |
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| Update Date | 2025-03-25 00:49:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176901 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H13NO3 |
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| Molecular Mass | 255.0895 |
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| SMILES | O=C1COc2ccccc2NC1c1ccc(O)cc1 |
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| InChI Key | YXCVTSOQQOQJKF-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 | oxazepines |
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| Subclass | 1,4-oxazepines |
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| Direct Parent | 1,4-oxazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersazacyclic compoundsbenzene and substituted derivativescyclic ketoneshydrocarbon derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundssecondary alkylarylamines |
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| Substituents | monocyclic benzene moietycarbonyl groupether1-hydroxy-2-unsubstituted benzenoidcyclic ketonealkyl aryl etherketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundazacyclesecondary aminepara-oxazepinesecondary aliphatic/aromatic amineoxacycleorganic oxygen compoundphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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