Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:16 UTC |
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Update Date | 2025-03-21 18:35:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00103644 |
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Frequency | 26.2 |
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Structure | |
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Chemical Formula | C7H7N3O3 |
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Molecular Mass | 181.0487 |
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SMILES | O=C(O)CNC(=O)c1ncccn1 |
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InChI Key | KKZRNNLCGJAXLA-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 | amino acids, peptides, and analogues |
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Direct Parent | acyl glycines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-heteroaryl carboxamidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidinecarboxylic acids and derivativessecondary carboxylic acid amides |
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Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compound2-heteroaryl carboxamidepyrimidineorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazacycleheteroaromatic compoundcarboxamide groupn-acylglycinesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundpyrimidine-2-carboxylic acid or derivativesorganooxygen compound |
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