| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:05 UTC |
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| Update Date | 2025-03-25 00:47:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160381 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H17N3O6S |
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| Molecular Mass | 355.0838 |
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| SMILES | NS(=O)(=O)c1ccc(NCC2=C(C(=O)O)NC(C(=O)O)CC2)cc1 |
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| InChI Key | GSIPJJVNJATISK-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 heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsaminosulfonyl compoundsazacyclic compoundsbenzenesulfonyl compoundscarbonyl compoundscarboxylic acidsdialkylaminesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganopnictogen compoundsorganosulfonamidesphenylalkylaminessecondary alkylarylaminestetrahydropyridines |
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| Substituents | organosulfonic acid or derivativescarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidalpha-amino acid or derivativesorganosulfur compoundcarboxylic acid derivativeorganosulfonic acid amideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundbenzenesulfonyl groupsecondary aliphatic aminebenzenesulfonamideazacycleaminosulfonyl compoundtetrahydropyridinesecondary aminesecondary aliphatic/aromatic aminesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesdicarboxylic acid or derivativesphenylalkylaminehydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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