| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:19 UTC |
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| Update Date | 2025-03-25 00:53:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02197334 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H10Cl2O3 |
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| Molecular Mass | 248.0007 |
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| SMILES | CCC(=O)OCOc1ccc(Cl)cc1Cl |
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| InChI Key | XFCAKXLPAJRQFA-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 | acetalsaryl chloridescarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesphenol ethersphenoxy compounds |
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| Substituents | aryl chloridephenol ethercarbonyl grouporganochloridecarboxylic acid derivativeorganohalogen compoundaryl halide1,3-dichlorobenzenearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacetalcarboxylic acid esterhydrocarbon derivativephenoxy compoundorganooxygen compound |
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