| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:02:41 UTC |
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| Update Date | 2025-03-21 19:01:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00210432 |
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| Frequency | 10.5 |
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| Structure | |
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| Chemical Formula | C5H6N2O3 |
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| Molecular Mass | 142.0378 |
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| SMILES | O=C(O)C(O)n1ccnc1 |
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| InChI Key | JRBLMFNCIIIYGR-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 | alpha amino acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkanolaminesalpha hydroxy acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazolesmonocarboxylic acids and derivativesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundazacyclealpha-hydroxy acidheteroaromatic compoundalpha-amino acid or derivativeshydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundalkanolamineazolen-substituted imidazole |
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