| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:52 UTC |
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| Update Date | 2025-03-25 00:47:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159915 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H10N2O3S |
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| Molecular Mass | 226.0412 |
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| SMILES | O=S1(=O)CCC(Nc2ccc(O)cc2)=N1 |
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| InChI Key | BOAMBKYQFQUMDM-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 | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | amidinesazacyclic compoundsbenzene and substituted derivativeshydrocarbon derivativesimidolactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundsorganosulfonic acids and derivativesthiazolines |
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| Substituents | organosulfonic acid or derivativesmonocyclic benzene moietyaromatic heteromonocyclic compoundazacycle1-hydroxy-2-unsubstituted benzenoidamidineorganic oxideorganic oxygen compoundorganic sulfonic acid or derivativesortho-thiazolineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganoheterocyclic compoundorganooxygen compound |
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