| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:12 UTC |
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| Update Date | 2025-03-21 18:28:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00074610 |
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| Frequency | 39.7 |
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| Structure | |
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| Chemical Formula | C8H8N2O2 |
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| Molecular Mass | 164.0586 |
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| SMILES | O=C(O)Cc1c[nH]c2[nH]ccc12 |
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| InChI Key | SEWOXNDRRYBINB-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 | azoles |
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| Subclass | azoles |
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| Direct Parent | azoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | carbonyl groupcarboxylic acidazacycleheteroaromatic compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundazole |
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