| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:01 UTC |
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| Update Date | 2025-03-21 18:06:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00062249 |
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| Frequency | 49.9 |
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| Structure | |
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| Chemical Formula | C7H4Cl2O3 |
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| Molecular Mass | 205.9537 |
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| SMILES | O=C(O)Oc1ccc(Cl)cc1Cl |
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| InChI Key | CGEIDBXZZNQURW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | dichlorobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chloridescarbonic acid monoesterscarbonyl compoundshydrocarbon derivativesorganic oxidesorganochloridesphenoxy compounds |
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| Substituents | aryl chloridecarbonyl groupcarbonic acid derivativeorganochlorideorganohalogen compoundaryl halide1,3-dichlorobenzenearomatic homomonocyclic compoundorganic oxidecarbonic acid monoesterorganic oxygen compoundhydrocarbon derivativephenoxy compoundorganooxygen compound |
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