| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:59 UTC |
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| Update Date | 2025-03-21 18:34:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00102964 |
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| Frequency | 26.4 |
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| Structure | |
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| Chemical Formula | C9H10N4O4 |
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| Molecular Mass | 238.0702 |
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| SMILES | NC(Cc1c[nH]c2c(=O)[nH]c(=O)[nH]c12)C(=O)O |
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| InChI Key | PJAGWCMIIJDFTG-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 |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkylaminesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidonespyrrolespyrrolopyrimidinesvinylogous amides |
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| Substituents | carbonyl grouplactamcarboxylic acidpyrimidonepyrimidinepyrrolopyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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