| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:47:15 UTC |
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| Update Date | 2025-03-24 17:58:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01027532 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C4H4ClNO2 |
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| Molecular Mass | 132.9931 |
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| SMILES | O=C1NCC(O)=C1Cl |
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| InChI Key | VLHMUEBQKNBILS-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 | pyrrolines |
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| Subclass | pyrrolines |
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| Direct Parent | pyrrolines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkanolaminesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeschloroalkeneshydrocarbon derivativeslactamsorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amidesvinyl chloridesvinylogous acids |
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| Substituents | carbonyl grouplactamorganochloridecarboxylic acid derivativeorganohalogen compoundorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundalkanolamineazacyclechloroalkenecarboxamide groupsecondary carboxylic acid amidevinylogous acidorganic oxygen compoundpyrrolinevinyl halidehaloalkenehydrocarbon derivativeorganic nitrogen compoundvinyl chlorideorganooxygen compound |
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