| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:40 UTC |
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| Update Date | 2025-03-25 00:46:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157293 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H3N3O |
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| Molecular Mass | 121.0276 |
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| SMILES | O=C1Nc2nccnc21 |
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| InChI Key | IWMKDSLDEKNXJN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | carboxylic acid derivatives |
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| Direct Parent | 2-heteroaryl carboxamides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidolactamslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrazinessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | vinylogous amidelactamazacycleheteroaromatic compound2-heteroaryl carboxamidesecondary carboxylic acid amideorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyrazineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganoheterocyclic compoundorganooxygen compound |
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