| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:15 UTC |
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| Update Date | 2025-03-25 00:58:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233857 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H19NO2S |
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| Molecular Mass | 253.1136 |
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| SMILES | Cc1cc(C)c(S(=O)(=O)N2CCCC2)c(C)c1 |
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| InChI Key | BJQGTRMOFVXKGW-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 | azacyclic compoundsbenzenesulfonyl compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidespyrrolidinessulfonyls |
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| Substituents | organosulfonic acid or derivativesbenzenesulfonamidearomatic heteromonocyclic compoundazacycleorganosulfur compoundorganosulfonic acid amideorganic oxidesulfonylorganic oxygen compoundorganic sulfonic acid or derivativesorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyrrolidineorganoheterocyclic compoundbenzenesulfonyl group |
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