| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:45 UTC |
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| Update Date | 2025-03-25 00:53:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02202950 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H17NO6S |
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| Molecular Mass | 327.0777 |
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| SMILES | O=C1CSc2ccccc2N1C1OC(CO)C(O)C(O)C1O |
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| InChI Key | QINDVKLGYCTLIY-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 | 1,4-thiazinesalkylarylthioethersazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativeslactamsmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstertiary carboxylic acid amides |
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| Substituents | carbonyl grouplactammonosaccharidebenzothiazinealkylarylthioethercarboxylic acid derivativearyl thioethersaccharideorganic oxidearomatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholalcoholpara-thiazineazacyclecarboxamide groupoxacycleorganic oxygen compoundthioethersecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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