| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:34 UTC |
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| Update Date | 2025-03-21 18:29:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00075502 |
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| Frequency | 39.1 |
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| Structure | |
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| Chemical Formula | C9H11NOS |
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| Molecular Mass | 181.0561 |
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| SMILES | CSc1ccc(NC(C)=O)cc1 |
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| InChI Key | IYTZTJQAOQJQGD-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 | acetanilides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acetamidesalkylarylthioetherscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesn-acetylarylaminesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidessulfenyl compoundsthiophenol ethersthiophenols |
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| Substituents | carbonyl groupn-acetylarylaminen-arylamidealkylarylthioetherorganosulfur compoundcarboxylic acid derivativearyl thioetherorganic oxidethiophenolthiophenol etherorganonitrogen compoundorganopnictogen compoundacetamidesulfenyl compoundacetanilidecarboxamide grouparomatic homomonocyclic compoundsecondary carboxylic acid amideorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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