| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:56:57 UTC |
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| Update Date | 2025-03-24 14:06:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00763143 |
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| Frequency | 2.0 |
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| Structure | |
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| Chemical Formula | C5H5N3O |
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| Molecular Mass | 123.0433 |
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| SMILES | CN1C(=O)c2[nH]cnc21 |
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| InChI Key | LSRIXLAYESYOLT-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 derivativesimidazolesimidolactamslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundstertiary carboxylic acid amidesvinylogous amides |
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| Substituents | vinylogous amidelactamazacycleheteroaromatic compound2-heteroaryl carboxamideorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundimidazoletertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganoheterocyclic compoundorganooxygen compoundazole |
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