| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:51 UTC |
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| Update Date | 2025-03-21 18:03:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00042965 |
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| Frequency | 79.3 |
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| Structure | |
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| Chemical Formula | C11H15N3O |
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| Molecular Mass | 205.1215 |
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| SMILES | CN1CCN(C(=O)c2cccnc2)CC1 |
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| InChI Key | GPYZMRYSJRWUDT-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 | pyridines and derivatives |
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| Subclass | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesn-methylpiperazinesorganic oxidesorganooxygen compoundsorganopnictogen compoundstertiary carboxylic acid amidestrialkylamines |
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| Substituents | pyridine carboxylic acid or derivativesaromatic heteromonocyclic compoundamino acid or derivativescarboxylic acid derivativeorganic oxidepiperazinetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundtertiary amineazacyclen-alkylpiperazineheteroaromatic compoundtertiary aliphatic aminen-methylpiperazinemethylpyridinecarboxamide grouporganic oxygen compound1,4-diazinanehydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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