| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 13:13:17 UTC |
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| Update Date | 2025-03-24 21:58:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01950702 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C4H3ClO3 |
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| Molecular Mass | 133.9771 |
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| SMILES | C=C(Cl)C(=O)C(=O)O |
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| InChI Key | VDHRXCJFBVJWKJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | halogenated fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalpha-branched alpha,beta-unsaturated ketonesalpha-chloroketonesalpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidschloroalkenesenonesfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesshort-chain keto acids and derivativesvinyl chlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidorganochlorideshort-chain keto acidalpha,beta-unsaturated ketonealpha-hydroxy ketonecarboxylic acid derivativeorganohalogen compoundketoneorganic oxidealpha-keto acidalpha-haloketoneenonehalogenated fatty acidalpha-branched alpha,beta-unsaturated-ketonechloroalkenealpha-chloroketonemonocarboxylic acid or derivativesorganic oxygen compoundketo acidvinyl halidehaloalkenehydrocarbon derivativeacryloyl-groupvinyl chlorideorganooxygen compound |
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