Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:42:15 UTC |
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Update Date | 2025-03-21 17:59:20 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00020321 |
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Frequency | 204.3 |
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Structure | |
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Chemical Formula | C9H10N2O3 |
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Molecular Mass | 194.0691 |
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SMILES | O=C(O)CCNC(=O)c1ccccn1 |
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InChI Key | HUTPCJXMUMODFL-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 | beta amino acids and derivatives |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-halopyridines2-heteroaryl carboxamidesazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyridinecarboxylic acids and derivativessecondary carboxylic acid amides |
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Substituents | pyridine carboxylic acid or derivativescarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundhydroxypyridinecarboxamide group2-heteroaryl carboxamidebeta amino acid or derivativessecondary carboxylic acid amideorganic oxidemonocarboxylic acid or derivativespyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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