| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:04 UTC |
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| Update Date | 2025-03-25 00:58:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02231150 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H19N3O4S |
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| Molecular Mass | 325.1096 |
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| SMILES | CCCN(CCC)S(=O)(=O)c1cccc2[nH]c(=O)[nH]c(=O)c12 |
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| InChI Key | DTDADLRVBYVTBE-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 compoundsbenzenoidsdiazanaphthalenesheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonamidespyrimidonesvinylogous amides |
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| Substituents | organosulfonic acid or derivativeslactampyrimidoneorganosulfur compoundpyrimidineorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundvinylogous amidecarbonic acid derivativeazacycleaminosulfonyl compoundheteroaromatic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundquinazolineorganooxygen compound |
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