| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:57:54 UTC |
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| Update Date | 2025-03-21 18:54:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00199341 |
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| Frequency | 11.2 |
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| Structure | |
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| Chemical Formula | C6H6ClNO |
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| Molecular Mass | 143.0138 |
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| SMILES | Nc1c(O)cccc1Cl |
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| InChI Key | JSHJJLQJRLNBBA-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 benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl chlorideschlorobenzeneshydrocarbon derivativesm-chlorophenolsorganochloridesorganooxygen compoundsorganopnictogen compoundsprimary amines |
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| Substituents | aryl chloridechlorobenzene3-halophenol3-chlorophenolmonocyclic benzene moietyorganochloride1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundhalobenzeneamineorganooxygen compound |
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