| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:18:04 UTC |
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| Update Date | 2025-03-24 20:41:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01533592 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H6N2O2 |
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| Molecular Mass | 126.0429 |
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| SMILES | O=C1CC2C(=O)NC2N1 |
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| InChI Key | MILFMPZHFCIFFI-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 | diazepanes |
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| Subclass | 1,3-diazepanes |
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| Direct Parent | 1,3-diazepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsazetidinesbeta lactamscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidine-2-onessecondary carboxylic acid amides |
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| Substituents | 2-pyrrolidone1,3-diazepanecarbonyl grouplactamazacyclecarboxamide groupcarboxylic acid derivativeazetidinealiphatic heteropolycyclic compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidinepyrrolidonebeta-lactamorganooxygen compound |
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