| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:53 UTC |
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| Update Date | 2025-03-25 00:59:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02237567 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H11N2O4S+ |
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| Molecular Mass | 279.0434 |
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| SMILES | NS(=O)(=O)c1ccc(-[n+]2cccc(C(=O)O)c2)cc1 |
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| InChI Key | PDMPLBJTYZWCCE-UHFFFAOYSA-O |
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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 | aminosulfonyl compoundsazacyclic compoundsbenzenesulfonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonamidespyridine-3-carboxylic acidsvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesorganosulfonic acid or derivativescarboxylic acidaromatic heteromonocyclic compoundpyridine-3-carboxylic acidorganosulfur compoundcarboxylic acid derivativeorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganoheterocyclic compoundbenzenesulfonyl groupvinylogous amidebenzenesulfonamideazacycleaminosulfonyl compoundheteroaromatic compoundhydroxypyridinemonocarboxylic acid or derivativessulfonylpyridineorganic oxygen compoundorganic sulfonic acid or derivativespyridine carboxylic acidhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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