| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 17:23:26 UTC |
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| Update Date | 2025-03-25 01:49:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02533258 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H9NO2 |
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| Molecular Mass | 127.0633 |
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| SMILES | C[N+]1([O-])C=CCCC1=O |
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| InChI Key | SKFIUROBRQECMR-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 | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganic oxoanionic compoundsorganonitrogen compoundsorganopnictogen compoundstrisubstituted amine oxides and derivatives |
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| Substituents | carbonyl groupazacyclen-oxidetetrahydropyridinecarboxylic acid derivativeorganic oxideorganic oxygen compoundtrisubstituted n-oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundorganic hyponitrite |
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