| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:21:46 UTC |
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| Update Date | 2025-03-25 00:40:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02113589 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C6H12NO+ |
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| Molecular Mass | 114.0913 |
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| SMILES | C[N+]1=CCC(O)CC1 |
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| InChI Key | NYGIADAAKREEDC-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 compoundshydrocarbon derivativesorganic cationsorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | alcoholazacycletetrahydropyridineorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganooxygen compound |
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