| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:10:05 UTC |
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| Update Date | 2025-03-24 16:42:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00938679 |
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| Frequency | 1.5 |
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| Structure | |
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| Chemical Formula | C4H6ClNO |
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| Molecular Mass | 119.0138 |
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| SMILES | O=C1CC(Cl)CN1 |
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| InChI Key | IQWRJWDGLYAZNR-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 | pyrrolidones |
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| Direct Parent | pyrrolidine-2-ones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkyl chloridesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativeslactamsorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | 2-pyrrolidonecarbonyl grouplactamazacyclealkyl chlorideorganochloridecarboxamide groupcarboxylic acid derivativeorganohalogen compoundsecondary carboxylic acid amideorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundalkyl halidehydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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