| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:22 UTC |
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| Update Date | 2025-03-21 18:35:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00106334 |
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| Frequency | 25.4 |
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| Structure | |
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| Chemical Formula | C9H6N4O4 |
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| Molecular Mass | 234.0389 |
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| SMILES | O=C(O)C=Cc1c[nH]c2nc(=O)[nH]c(=O)c-2n1 |
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| InChI Key | AFGNMVMEUXTTKG-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 | pteridines and derivatives |
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| Subclass | pteridines and derivatives |
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| Direct Parent | pteridines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrazinespyrimidones |
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| Substituents | carbonyl groupcarbonic acid derivativelactamcarboxylic acidazacycleheteroaromatic compoundpyrimidonepteridinecarboxylic acid derivativepyrimidineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyrazineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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