| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:45:49 UTC |
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| Update Date | 2025-03-21 18:50:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00171275 |
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| Frequency | 33.0 |
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| Structure | |
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| Chemical Formula | C3H3N3O2 |
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| Molecular Mass | 113.0225 |
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| SMILES | O=C(O)c1c[nH]nn1 |
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| InChI Key | GTODOEDLCNTSLG-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 | triazole carboxylic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidecarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound1,2,3-triazole carboxylic acid |
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