| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:51 UTC |
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| Update Date | 2025-03-21 18:36:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00109987 |
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| Frequency | 24.3 |
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| Structure | |
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| Chemical Formula | C13H11ClO2 |
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| Molecular Mass | 234.0448 |
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| SMILES | CC(C(=O)O)c1ccc2cc(Cl)ccc2c1 |
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| InChI Key | CNZUNYCTTCEWOQ-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 | naphthalenes |
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| Subclass | chloronaphthalenes |
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| Direct Parent | chloronaphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl chloridescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochlorides |
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| Substituents | aryl chloridecarbonyl groupcarboxylic acidorganochloridechloronaphthalenearomatic homopolycyclic compoundcarboxylic acid derivativeorganohalogen compoundaryl halideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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