Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:51:39 UTC |
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Update Date | 2025-03-25 00:50:39 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02182279 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C4H8N2O4S |
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Molecular Mass | 180.0205 |
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SMILES | O=C(O)C1CNS(=O)(=O)CN1 |
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InChI Key | IQFZKYPBMOWIQZ-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 | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic sulfonamidesorganopnictogen compoundsorganosulfonamidesthiadiazinanes |
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Substituents | organosulfonic acid or derivativescarbonyl groupcarboxylic acidamino acidorganosulfonic acid amideorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundthiadiazinanesecondary aliphatic amineazacyclesecondary aminemonocarboxylic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amideorganooxygen compoundamine |
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