| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:18 UTC |
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| Update Date | 2025-03-21 18:36:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111080 |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C12H14N4O3 |
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| Molecular Mass | 262.1066 |
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| SMILES | O=C1CCCN2C(=O)C(Cc3cnc[nH]3)NC(=O)C12 |
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| InChI Key | OKCVUJVPTUOFFK-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 | piperazinopiperidines |
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| Subclass | piperazinopiperidines |
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| Direct Parent | piperazinopiperidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compounds2,5-dioxopiperazinesalpha amino acidsazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesketoneslactamsn-alkylpiperazinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspiperidinonessecondary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | carbonyl grouplactamalpha-amino acid or derivatives2,5-dioxopiperazinecarboxylic acid derivativeketoneorganic oxidedioxopiperazinepiperazinearomatic heteropolycyclic compoundimidazoletertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundpiperidinonepiperidinepiperazino-1,2-a-piperidineazoleazacyclen-alkylpiperazineheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compound1,4-diazinanehydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundorganooxygen compound |
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