Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:53:40 UTC |
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Update Date | 2025-03-25 00:51:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02186900 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C13H11ClN2O4S |
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Molecular Mass | 326.0128 |
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SMILES | NS(=O)(=O)c1ccc(NC(=O)c2ccccc2O)cc1Cl |
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InChI Key | KISUDCGKGOHVFK-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 | benzene and substituted derivatives |
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Subclass | anilides |
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Direct Parent | benzanilides |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaminosulfonyl compoundsaryl chloridesbenzamidesbenzenesulfonamidesbenzenesulfonyl compoundsbenzoyl derivativescarboxylic acids and derivativeschlorobenzeneshydrocarbon derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonamidessalicylamidessecondary carboxylic acid amidesvinylogous acids |
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Substituents | organosulfonic acid or derivativesbenzanilideorganochloridebenzoyl1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundcarboxylic acid derivativeorganohalogen compoundbenzamideorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundbenzenesulfonyl grouparyl chloridechlorobenzenebenzenesulfonamideaminosulfonyl compoundbenzoic acid or derivatives1-hydroxy-4-unsubstituted benzenoidcarboxamide groupsalicylamidearyl halidearomatic homomonocyclic compoundsecondary carboxylic acid amidevinylogous acidsulfonylorganic oxygen compoundsalicylic acid or derivativesorganic sulfonic acid or derivativesphenolhydrocarbon derivativeorganic nitrogen compoundhalobenzeneorganooxygen compound |
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