| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:42 UTC |
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| Update Date | 2025-03-25 00:51:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186973 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H13N3O4S2 |
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| Molecular Mass | 279.0347 |
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| SMILES | NS(=O)(=O)CCNc1ccc(S(N)(=O)=O)cc1 |
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| InChI Key | JATDAFHJCXHUGQ-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 | benzenesulfonamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsbenzenesulfonyl compoundshydrocarbon derivativesorganic oxidesorganic sulfonamidesorganopnictogen compoundsorganosulfonamidesphenylalkylaminessecondary alkylarylamines |
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| Substituents | organosulfonic acid or derivativesbenzenesulfonamideaminosulfonyl compoundsecondary amineorganosulfur compoundsecondary aliphatic/aromatic amineorganosulfonic acid amidearomatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundphenylalkylaminehydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amideaminebenzenesulfonyl group |
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