| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:23:13 UTC |
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| Update Date | 2025-03-25 01:02:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02254392 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17N3O2S |
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| Molecular Mass | 279.1041 |
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| SMILES | CC(C)(C)c1ccn(-c2ccc(S(N)(=O)=O)cc2)n1 |
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| InChI Key | UNZSVVJRMSEDEJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azoles |
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| Subclass | pyrazoles |
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| Direct Parent | phenylpyrazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsazacyclic compoundsbenzenesulfonamidesbenzenesulfonyl compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamides |
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| Substituents | organosulfonic acid or derivativesmonocyclic benzene moietybenzenesulfonamidearomatic heteromonocyclic compoundazacycleaminosulfonyl compoundheteroaromatic compoundorganosulfur compoundorganosulfonic acid amidephenylpyrazoleorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundbenzenesulfonyl group |
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