| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:14 UTC |
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| Update Date | 2025-03-25 00:50:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183581 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H10ClNO2 |
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| Molecular Mass | 211.04 |
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| SMILES | O=C1NCCC1(O)c1ccc(Cl)cc1 |
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| InChI Key | KRHUZWJSADMROZ-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 | aryl chloridesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeschlorobenzeneshydrocarbon derivativeslactamsorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundspyrrolespyrrolidine-2-onessecondary carboxylic acid amidestertiary alcohols |
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| Substituents | 2-pyrrolidonemonocyclic benzene moietycarbonyl grouplactamaromatic heteromonocyclic compoundorganochloridecarboxylic acid derivativeorganohalogen compoundorganic oxideorganonitrogen compoundorganopnictogen compoundpyrrolidonearyl chloridechlorobenzenealcoholazacyclecarboxamide grouparyl halidesecondary carboxylic acid amide3-phenylpyrrolidinetertiary alcoholorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compound |
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