| Record Information | 
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| HMDB Status | Not Available | 
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| Creation Date | 2024-02-21 14:56:59 UTC | 
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| Update Date | 2025-03-25 00:52:31 UTC | 
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| HMDB ID | Not Available | 
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| Metabolite Identification | 
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| DeepMet ID | DMID02194307 | 
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| Frequency | 0.5 | 
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| Structure |  | 
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| Chemical Formula | C13H11N3O | 
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| Molecular Mass | 225.0902 | 
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| SMILES | CN1C(=O)c2cnccc2C1c1cccnc1 | 
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| InChI Key | ITMXDPIBWABMDZ-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 | pyrrolopyridines | 
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| Subclass | pyrrolopyridines | 
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| Direct Parent | pyrrolopyridines | 
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| Geometric Descriptor | aromatic heteropolycyclic compounds | 
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| Alternative Parents | azacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsmethylpyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyrrolestertiary carboxylic acid amides | 
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| Substituents | lactamazacyclepyrrolopyridinepolyhalopyridineheteroaromatic compoundmethylpyridinecarboxamide groupcarboxylic acid derivativeorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroletertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound | 
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