| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:05:33 UTC |
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| Update Date | 2025-03-24 21:28:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01790320 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C5H5ClO2 |
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| Molecular Mass | 131.9978 |
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| SMILES | CCC(=O)C(Cl)=C=O |
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| InChI Key | AWBJAASCMUQEEU-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 | alpha-chloroketonesenoneshydrocarbon derivativesorganic oxidesorganochloridesvinyl chloridesynolates |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganochlorideorganohalogen compoundalpha-chloroketoneketoneorganic oxideynolatevinyl halidealpha-haloketonehydrocarbon derivativeacryloyl-groupvinyl chlorideenone |
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