| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:40 UTC |
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| Update Date | 2025-03-21 18:39:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00123861 |
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| Frequency | 20.8 |
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| Structure | |
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| Chemical Formula | C11H7ClO2 |
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| Molecular Mass | 206.0135 |
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| SMILES | O=C(O)c1ccc2ccc(Cl)cc2c1 |
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| InChI Key | JNQBWHQIVRNISC-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 | naphthalenecarboxylic acids and derivatives |
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| Direct Parent | naphthalenecarboxylic acids |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl chloridescarboxylic acidschloronaphthaleneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesorganooxygen compounds |
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| Substituents | aryl chloridecarboxylic acidorganochloridechloronaphthalenearomatic homopolycyclic compoundcarboxylic acid derivativeorganohalogen compoundaryl halideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivative2-naphthalenecarboxylic acidorganooxygen compound |
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