| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:33:59 UTC |
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| Update Date | 2025-03-21 17:56:27 UTC |
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| HMDB ID | HMDB0001046 |
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| Metabolite Identification |
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| DeepMet ID | DMID00001444 |
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| Name | Cotinine |
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| Frequency | 4106.0 |
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| Structure | |
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| Chemical Formula | C10H12N2O |
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| Molecular Mass | 176.095 |
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| SMILES | CN1C(=O)CCC1c1cccnc1 |
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| InChI Key | UIKROCXWUNQSPJ-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 | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkaloids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsmethylpyridinesn-alkylpyrrolidinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolidine-2-onestertiary carboxylic acid amides |
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| Substituents | 2-pyrrolidonecarbonyl grouplactamaromatic heteromonocyclic compoundpyrrolidinylpyridinecarboxylic acid derivativeorganic oxidetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundpyrrolidinepyrrolidoneazacyclen-alkylpyrrolidineheteroaromatic compoundmethylpyridinecarboxamide groupalkaloid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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