| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:57:58 UTC |
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| Update Date | 2025-03-21 18:05:30 UTC |
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| HMDB ID | HMDB0034413 |
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| Metabolite Identification |
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| DeepMet ID | DMID00057337 |
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| Name | 1,2-Benzisothiazol-3(2H)-one |
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| Frequency | 65.9 |
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| Structure | |
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| Chemical Formula | C7H5NOS |
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| Molecular Mass | 151.0092 |
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| SMILES | Oc1nsc2ccccc12 |
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| InChI Key | DMSMPAJRVJJAGA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzothiazoles |
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| Subclass | benzothiazoles |
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| Direct Parent | benzothiazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsthiazoles |
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| Substituents | azacycleheteroaromatic compound1,2-benzothiazoleorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundthiazoleorganooxygen compoundazole |
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