| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:46 UTC |
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| Update Date | 2025-03-25 00:52:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02191613 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H18N2O9S |
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| Molecular Mass | 330.0733 |
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| SMILES | CC(=O)NC1C(O)C(O)C(CO)OC(O)C1NS(=O)(=O)O |
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| InChI Key | ALYPWYQJMCWLKI-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 | oxepanes |
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| Subclass | oxepanes |
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| Direct Parent | oxepanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidescarbonyl compoundscarboxylic acids and derivativeshemiacetalshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholssecondary carboxylic acid amidessulfuric acid monoamides |
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| Substituents | alcoholcarbonyl grouporganic sulfuric acid or derivativescarboxamide groupcarboxylic acid derivativeoxepaneoxacyclesecondary carboxylic acid amideorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsulfuric acid monoamidesecondary alcoholorganopnictogen compoundhemiacetalhydrocarbon derivativeorganic nitrogen compoundprimary alcoholacetamideorganooxygen compound |
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