Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 03:02:12 UTC |
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Update Date | 2025-03-21 22:07:20 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00490430 |
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Frequency | 3.5 |
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Structure | |
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Chemical Formula | C4H5ClO |
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Molecular Mass | 104.0029 |
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SMILES | CC(=O)C=CCl |
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InChI Key | HTPABEPAZTWGPP-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | acryloyl compounds |
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Direct Parent | acryloyl compounds |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | chloroalkenesenoneshydrocarbon derivativesketonesorganic oxidesorganochloridesvinyl chloridesvinylogous halides |
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Substituents | aliphatic acyclic compoundcarbonyl groupchloroalkeneorganochloridealpha,beta-unsaturated ketoneorganohalogen compoundvinylogous halideketoneorganic oxidevinyl halidehaloalkenehydrocarbon derivativeacryloyl-groupvinyl chlorideenone |
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