| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:15 UTC |
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| Update Date | 2025-03-25 00:45:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151713 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H10N4O4S |
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| Molecular Mass | 258.0423 |
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| SMILES | Cn1c(S(C)(=O)=O)nc2c1c(=O)[nH]c(=O)n2C |
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| InChI Key | AEPUXOPMAYUQJA-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 | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | purinones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonessulfonesvinylogous amides |
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| Substituents | lactampyrimidoneorganosulfur compoundpurinonepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolen-substituted imidazolevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundsulfonylorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundsulfone |
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