| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:26 UTC |
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| Update Date | 2025-03-25 00:57:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02225392 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H11NO3S |
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| Molecular Mass | 225.046 |
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| SMILES | CC(=O)Nc1ccccc1C(=O)S(C)=O |
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| InChI Key | IHCJUJCRTRCKSL-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 | benzoic acids and derivatives |
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| Direct Parent | acylaminobenzoic acid and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acetamidesacetanilidesbenzoyl derivativesbenzyl alkyl sulfoxidescarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesn-acetylarylaminesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidessulfinyl compoundssulfoxidesthiobenzoic acids and derivativesthiolactonesvinylogous amides |
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| Substituents | carbonyl groupn-acetylarylaminebenzoyln-arylamideorganosulfur compoundcarboxylic acid derivativeorganic oxidesulfinyl compoundorganonitrogen compoundorganopnictogen compoundthiolactonethiobenzoic acid or derivativesacetamidevinylogous amideacylaminobenzoic acid or derivativesacetanilidecarboxamide grouparomatic homomonocyclic compoundanilidesecondary carboxylic acid amideorganic oxygen compoundbenzyl sulfoxidesulfoxidehydrocarbon derivativeorganic nitrogen compoundbenzyl alkyl sulfoxideorganooxygen compound |
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