| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:13 UTC |
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| Update Date | 2025-03-21 18:33:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098591 |
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| Frequency | 27.9 |
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| Structure | |
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| Chemical Formula | C5H8N4O |
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| Molecular Mass | 140.0698 |
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| SMILES | Cn1ncc(C(N)=O)c1N |
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| InChI Key | JGSQVTVXGXOSCH-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 | pyrazoles |
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| Direct Parent | pyrazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminesprimary carboxylic acid amidesvinylogous amides |
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| Substituents | primary carboxylic acid amidevinylogous amidearomatic heteromonocyclic compoundazacycleamino acid or derivativesheteroaromatic compoundcarboxamide groupcarboxylic acid derivativepyrazoleorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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