| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:48 UTC |
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| Update Date | 2025-03-25 00:59:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237396 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H12N2O2 |
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| Molecular Mass | 240.0899 |
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| SMILES | O=C1CC(c2cccnc2)Oc2ccccc2N1 |
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| InChI Key | CSSOCKYBSHNMOC-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 | alkyl aryl ethersazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyridines and derivativessecondary carboxylic acid amides |
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| Substituents | carbonyl groupetherlactamazacycleheteroaromatic compoundalkyl aryl ethercarboxamide groupcarboxylic acid derivativepara-oxazepineoxacyclesecondary carboxylic acid amideorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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