| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:01 UTC |
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| Update Date | 2025-03-25 00:49:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171631 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13N3O6S2 |
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| Molecular Mass | 323.0246 |
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| SMILES | CN(CC(=O)O)c1ccc(S(N)(=O)=O)cc1S(N)(=O)=O |
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| InChI Key | WXNRQEDYCJVGCG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzenesulfonamides |
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| Direct Parent | aminobenzenesulfonamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsaminosulfonyl compoundsaniline and substituted anilinesbenzenesulfonyl compoundscarbonyl compoundscarboxylic acidsdialkylarylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsorganosulfonamides |
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| Substituents | organosulfonic acid or derivativescarbonyl groupaminobenzenesulfonamidecarboxylic acidamino acid or derivativesamino acidalpha-amino acid or derivativesorganosulfur compoundcarboxylic acid derivativeorganosulfonic acid amideorganic oxidetertiary aliphatic/aromatic aminealpha-amino acidorganonitrogen compoundorganopnictogen compounddialkylarylaminetertiary aminebenzenesulfonyl groupaminosulfonyl compoundaniline or substituted anilinesaromatic homomonocyclic compoundmonocarboxylic acid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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