| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:20 UTC |
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| Update Date | 2025-03-21 18:28:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00074931 |
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| Frequency | 39.5 |
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| Structure | |
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| Chemical Formula | C8H7N3O |
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| Molecular Mass | 161.0589 |
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| SMILES | O=C1CN=C(c2cccnc2)N1 |
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| InChI Key | FNHLCDXOSXIROD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolinonesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyridines and derivatives |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic 1,3-dipolar compoundcarboximidamidepropargyl-type 1,3-dipolar organic compoundorganic oxidepyridineorganic oxygen compound2-imidazolineimidazolineorganonitrogen compoundalpha-amino acidorganopnictogen compoundimidazolinonehydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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