| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:08 UTC |
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| Update Date | 2025-03-25 00:57:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224752 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6ClNO2S |
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| Molecular Mass | 190.9808 |
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| SMILES | NS(=O)c1ccc(O)c(Cl)c1 |
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| InChI Key | RCRFGKLUVRMNEX-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 | phenols |
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| Subclass | halophenols |
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| Direct Parent | halophenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaminosulfinyl compoundsaryl chlorideschlorobenzeneshydrocarbon derivativeso-chlorophenolsorganic nitrogen compoundsorganic oxidesorganochloridesorganooxygen compoundssulfinic acid amides |
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| Substituents | aryl chloride2-chlorophenolchlorobenzenemonocyclic benzene moietyorganochloridesulfinic acid derivative1-hydroxy-2-unsubstituted benzenoidsulfinic acid amideorganosulfur compoundorganohalogen compoundaryl halidearomatic homomonocyclic compoundaminosulfinyl compound2-halophenolorganic oxidesulfinyl compoundorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzeneorganooxygen compound |
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