| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:55 UTC |
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| Update Date | 2025-03-21 18:06:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00064338 |
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| Frequency | 72.6 |
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| Structure | |
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| Chemical Formula | C7H6N4O3 |
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| Molecular Mass | 194.044 |
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| SMILES | Nc1nc2cc(C(=O)O)[nH]c2c(=O)[nH]1 |
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| InChI Key | BLBHVLBBGVTKHK-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 | pyrrolopyrimidines |
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| Subclass | pyrrolopyrimidines |
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| Direct Parent | pyrrolopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeslactamsmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidinecarboxylic acidspyrimidonespyrrole 2-carboxylic acidspyrrole carboxylic acids and derivatives |
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| Substituents | lactamcarboxylic acidamino acid or derivativesamino acidpyrimidonecarboxylic acid derivativepyrimidinepyrrolopyrimidineorganic oxidepyrrole-2-carboxylic acidpyrrole-2-carboxylic acid or derivativesaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrimidine-6-carboxylic acidazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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