| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:05 UTC |
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| Update Date | 2025-03-25 00:57:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224633 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H8N2O4S2 |
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| Molecular Mass | 271.9925 |
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| SMILES | NS(=O)(=O)c1ccc2c(c1)N=C(C(=O)O)CS2 |
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| InChI Key | LPOBFKMTIXSRHY-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-thiazinesalkylarylthioethersaminosulfonyl compoundsazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidshydrocarbon derivativesketiminesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsorganosulfonamidespropargyl-type 1,3-dipolar organic compounds |
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| Substituents | ketimineorganosulfonic acid or derivativescarbonyl groupcarboxylic acidiminebenzothiazinealkylarylthioetherorganosulfur compoundcarboxylic acid derivativearyl thioetherpropargyl-type 1,3-dipolar organic compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpara-thiazineazacycleaminosulfonyl compoundorganic 1,3-dipolar compoundmonocarboxylic acid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativesthioetherhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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