| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:53 UTC |
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| Update Date | 2025-03-25 01:00:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242142 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H17N3O3S |
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| Molecular Mass | 343.0991 |
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| SMILES | CC(C)c1nc2ccccc2c(=O)n1-c1ccc(S(N)(=O)=O)cc1 |
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| InChI Key | JPOKQIBMDSXNHU-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 | diazanaphthalenes |
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| Subclass | benzodiazines |
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| Direct Parent | quinazolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aminosulfonyl compoundsazacyclic compoundsbenzenesulfonamidesbenzenesulfonyl compoundsdiazanaphthalenesheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonamidespyrimidones |
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| Substituents | organosulfonic acid or derivativesmonocyclic benzene moietylactampyrimidoneorganosulfur compoundpyrimidineorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundbenzenesulfonyl groupbenzenesulfonamideazacycleaminosulfonyl compoundheteroaromatic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundquinazolineorganooxygen compound |
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