| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:30 UTC |
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| Update Date | 2025-03-21 18:34:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00099290 |
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| Frequency | 44.1 |
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| Structure | |
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| Chemical Formula | C10H12N2O+ |
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| Molecular Mass | 176.0944 |
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| SMILES | CN1C(=O)CCC1C1=C[N+]=CC=C1 |
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| InChI Key | DLUHORHHUGIAHJ-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 | pyrrolidinylpyridines |
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| Direct Parent | pyrrolidinylpyridines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesimineslactamsn-alkylpyrrolidinesorganic cationsorganic oxidesorganopnictogen compoundspyrrolidine-2-onestertiary carboxylic acid amides |
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| Substituents | 2-pyrrolidonecarbonyl grouplactamazacyclen-alkylpyrrolidinepyrrolidinylpyridineiminecarboxamide groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundtertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationpyrrolidinepyrrolidoneorganooxygen compound |
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