| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:10:36 UTC |
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| Update Date | 2025-03-21 18:31:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00087460 |
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| Frequency | 32.5 |
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| Structure | |
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| Chemical Formula | C8H7N3O4 |
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| Molecular Mass | 209.0437 |
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| SMILES | Cn1c(=O)[nH]c(=O)c2cc(C(=O)O)[nH]c21 |
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| InChI Key | MRBQGYMETKGOIO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidinecarboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonespyrrole 2-carboxylic acidspyrrole carboxylic acids and derivativespyrrolo[2,3-d]pyrimidinesvinylogous amides |
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| Substituents | lactamcarboxylic acidpyrimidonecarboxylic acid derivativepyrrolopyrimidineorganic oxidepyrrolo[2,3-d]pyrimidinepyrrole-2-carboxylic acidpyrrole-2-carboxylic acid or derivativesaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrimidine-6-carboxylic acidvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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