| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:02 UTC |
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| Update Date | 2025-03-21 18:06:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00064613 |
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| Frequency | 54.9 |
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| Structure | |
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| Chemical Formula | C9H9N3O |
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| Molecular Mass | 175.0746 |
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| SMILES | CNc1nc(=O)c2ccccc2[nH]1 |
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| InChI Key | INOFKGBTXNAMCH-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 | diazanaphthalenes |
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| Subclass | benzodiazines |
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| Direct Parent | quinazolinamines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsdiazanaphthalenesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundspyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | vinylogous amideazacycleheteroaromatic compoundpyrimidonesecondary aminesecondary aliphatic/aromatic aminepyrimidineorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundquinazolinamineorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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