| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:18 UTC |
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| Update Date | 2025-03-25 00:47:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160839 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9N5O4S |
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| Molecular Mass | 271.0375 |
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| SMILES | Nc1nc2ncc(CCS(=O)(=O)O)nc2c(=O)[nH]1 |
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| InChI Key | FODUSBJVAATOQI-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 | pteridines and derivatives |
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| Subclass | pterins and derivatives |
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| Direct Parent | pterins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundsorganosulfonic acidsprimary aminespyrazinespyrimidonessulfonyls |
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| Substituents | organosulfonic acid or derivativeslactamorganosulfonic acidpyrimidoneorganosulfur compoundpyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpterinazacycleheteroaromatic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativespyrazinehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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