| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:00 UTC |
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| Update Date | 2025-03-25 01:00:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02244785 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H12N4O6S |
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| Molecular Mass | 268.0478 |
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| SMILES | CN(C(=N)NC(CC(=O)O)C(=O)O)S(N)(=O)=O |
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| InChI Key | JQZPSUOIJKQYEY-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 | aspartic acid and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboximidamidescarboxylic acidsdicarboxylic acids and derivativesfatty acids and conjugatesguanidineshydrocarbon derivativesiminesorganic oxidesorganic sulfuric acids and derivativesorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidorganic sulfuric acid or derivativesguanidineiminefatty acidcarboximidamideorganic oxideorganic oxygen compoundaspartic acid or derivativesorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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