| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:30 UTC |
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| Update Date | 2025-03-25 00:47:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161312 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H16N4O4S |
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| Molecular Mass | 264.0892 |
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| SMILES | NC(N)=NCCS(=O)(=O)N1CCCC1C(=O)O |
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| InChI Key | JYEYLPJAYWLXAY-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 | proline and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidsguanidineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic sulfonamidesorganopnictogen compoundsorganosulfonamidespropargyl-type 1,3-dipolar organic compoundspyrrolidine carboxylic acidssulfonyls |
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| Substituents | organosulfonic acid or derivativescarbonyl groupcarboxylic acidguanidineorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundorganosulfonic acid amideorganic oxidepyrrolidine carboxylic acidaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativesazacycleorganic 1,3-dipolar compoundcarboximidamidemonocarboxylic acid or derivativessulfonylpyrrolidine carboxylic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amideorganooxygen compound |
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