| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:58 UTC |
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| Update Date | 2025-03-25 00:50:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182976 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H7ClO4S |
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| Molecular Mass | 257.9754 |
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| SMILES | O=S(=O)(O)Oc1c(Cl)ccc2ccccc12 |
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| InChI Key | QHPDHFYYCQSNQS-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 chloridesarylsulfateshydrocarbon derivativesorganic oxidesorganochloridesorganooxygen compoundssulfuric acid monoesters |
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| Substituents | aryl chloridesulfuric acid monoesterorganic sulfuric acid or derivativesorganochloridechloronaphthalenearomatic homopolycyclic compoundorganohalogen compoundaryl halideorganic oxideorganic oxygen compoundsulfate-esterhydrocarbon derivativearylsulfatesulfuric acid esterorganooxygen compound |
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