| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:24 UTC |
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| Update Date | 2025-03-21 18:36:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00108891 |
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| Frequency | 24.6 |
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| Structure | |
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| Chemical Formula | C7H5N3O2 |
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| Molecular Mass | 163.0382 |
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| SMILES | O=C(O)c1c[nH]c2cncnc12 |
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| InChI Key | ZKBNVBSWMYQAEE-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 | 1-carboxy-2-haloaromatic compoundsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidines and pyrimidine derivativespyrrole carboxylic acidsvinylogous amides |
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| Substituents | vinylogous amidecarboxylic acidazacyclepyrrole-3-carboxylic acid or derivativesheteroaromatic compoundcarboxylic acid derivativepyrimidinepyrrolopyrimidineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1-carboxy-2-haloaromatic compoundorganic nitrogen compoundpyrrole-3-carboxylic acidorganooxygen compound |
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