| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:16 UTC |
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| Update Date | 2025-03-25 00:54:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204133 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H13NO3 |
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| Molecular Mass | 243.0895 |
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| SMILES | Oc1ccc2c(c1)NCCc1cc(O)c(O)cc1-2 |
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| InChI Key | ZMNXKPVLQLICRN-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 | benzazepines |
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| Subclass | dibenzazepines |
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| Direct Parent | dibenzazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsazacyclic compoundsazepinesbenzenoidshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundssecondary alkylarylamines |
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| Substituents | azacycle1-hydroxy-2-unsubstituted benzenoidsecondary aminesecondary aliphatic/aromatic amineorganic oxygen compoundazepinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compounddibenzazepine |
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