| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:29:08 UTC |
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| Update Date | 2025-03-21 18:41:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00132121 |
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| Frequency | 19.1 |
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| Structure | |
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| Chemical Formula | C11H13NO |
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| Molecular Mass | 175.0997 |
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| SMILES | Cc1ccc(N2CCCC2=O)cc1 |
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| InChI Key | ORPHOKOVVUFNKE-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 | pyrrolidines |
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| Subclass | phenylpyrrolidines |
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| Direct Parent | phenylpyrrolidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolespyrrolidine-2-onestertiary carboxylic acid amidestoluenes |
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| Substituents | 2-pyrrolidonemonocyclic benzene moietycarbonyl grouplactam1-phenylpyrrolidinearomatic heteromonocyclic compoundazacyclecarboxamide groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundpyrroletertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyrrolidonetolueneorganooxygen compound |
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