Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 16:46:49 UTC |
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Update Date | 2025-03-25 01:34:17 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02448177 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C7H10NO+ |
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Molecular Mass | 124.0757 |
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SMILES | C[N+]1(C)C=CC(=O)C=C1 |
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InChI Key | FGBVYWWGMBXUMA-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 | dihydropyridines |
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Geometric Descriptor | aliphatic heteromonocyclic compounds |
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Alternative Parents | aminesazacyclic compoundscyclic ketoneshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsquaternary ammonium salts |
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Substituents | carbonyl groupazacyclequaternary ammonium saltcyclic ketoneketoneorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationdihydropyridineorganic saltamineorganooxygen compound |
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