| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:08 UTC |
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| Update Date | 2025-03-25 00:50:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02178829 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17NO3S |
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| Molecular Mass | 267.0929 |
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| SMILES | COC1=NC(CC(C)C)S(=O)(=O)c2ccccc21 |
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| InChI Key | AHMMMVKQOSCJMO-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 | benzothiazines |
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| Subclass | benzothiazines |
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| Direct Parent | benzothiazines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-thiazinesazacyclic compoundsbenzenoidshydrocarbon derivativesimidolactonesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssulfones |
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| Substituents | azacyclebenzothiazineorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundmeta-thiazinehydrocarbon derivativeimidolactonebenzenoidorganic nitrogen compoundorganooxygen compoundsulfone |
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