Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-21 02:09:38 UTC |
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Update Date | 2025-03-21 20:48:53 UTC |
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HMDB ID | HMDB0060457 |
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Metabolite Identification |
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DeepMet ID | DMID00365825 |
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Name | cis-3-Chloroacrylic acid |
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Frequency | 5.1 |
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Structure | |
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Chemical Formula | C3H3ClO2 |
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Molecular Mass | 105.9822 |
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SMILES | O=C(O)C=CCl |
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InChI Key | MHMUCYJKZUZMNJ-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organohalogen compounds |
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Class | vinyl halides |
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Subclass | vinylogous halides |
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Direct Parent | vinylogous halides |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acidschloroalkeneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesvinyl chlorides |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidchloroalkeneorganochloridecarboxylic acid derivativevinylogous halideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhaloalkenehydrocarbon derivativevinyl chlorideorganooxygen compound |
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