| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:58:47 UTC |
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| Update Date | 2025-03-21 20:09:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00340157 |
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| Frequency | 5.6 |
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| Structure | |
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| Chemical Formula | C5H9NO |
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| Molecular Mass | 99.0684 |
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| SMILES | OC1CCC=NC1 |
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| InChI Key | VRPVDMXPPAZPAT-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 derivativesiminesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary alcohols |
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| Substituents | alcoholazacycleiminetetrahydropyridineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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