| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:06 UTC |
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| Update Date | 2025-03-25 01:00:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245034 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14N2O |
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| Molecular Mass | 178.1106 |
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| SMILES | CN1CCNc2ccc(O)cc2C1 |
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| InChI Key | XRFIVGXNEOCOAZ-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 | benzodiazepines |
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| Subclass | 1,4-benzodiazepines |
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| Direct Parent | 1,4-benzodiazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaralkylaminesazacyclic compoundsbenzenoidshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundssecondary alkylarylaminestrialkylamines |
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| Substituents | azacycletertiary aliphatic amine1-hydroxy-2-unsubstituted benzenoidsecondary aminearalkylaminesecondary aliphatic/aromatic amine1,4-benzodiazepineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminetertiary amineorganooxygen compound |
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