| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:29 UTC |
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| Update Date | 2025-03-25 01:01:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252772 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H15NO6S |
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| Molecular Mass | 241.062 |
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| SMILES | NC(C[SH]1OC(CO)C(O)C1O)C(=O)O |
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| InChI Key | ZYPCYDUPDVWQHG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkylthiolscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfur compoundsoxacyclic compoundsoxathiolanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidoxathiolaneorganosulfur compoundoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundprimary alcoholalkylthiolorganoheterocyclic compoundorganooxygen compound |
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