| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:05:07 UTC |
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| Update Date | 2025-03-21 19:03:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00216232 |
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| Frequency | 17.1 |
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| Structure | |
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| Chemical Formula | C5H5N3O2 |
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| Molecular Mass | 139.0382 |
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| SMILES | O=C(O)C=Cc1nc[nH]n1 |
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| InChI Key | RTHKKPZTBOIQJE-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 | triazoles |
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| Direct Parent | triazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | triazolecarbonyl groupcarboxylic acidaromatic heteromonocyclic compound1,2,4-triazoleazacycleheteroaromatic compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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