| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:30:06 UTC |
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| Update Date | 2025-03-21 20:57:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00414387 |
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| Frequency | 4.4 |
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| Structure | |
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| Chemical Formula | C5H8N2O |
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| Molecular Mass | 112.0637 |
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| SMILES | NC1=NCC(=O)CC1 |
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| InChI Key | HQAMBUSNFNCHJH-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 | hydropyridines |
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| Direct Parent | tetrahydropyridines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | amidinesazacyclic compoundscarboximidamidescyclic ketoneshydrocarbon derivativesimidolactamsorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | carbonyl groupazacycletetrahydropyridineorganic 1,3-dipolar compoundcyclic ketoneamidinecarboximidamidepropargyl-type 1,3-dipolar organic compoundketoneorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganooxygen compound |
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