| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:02 UTC |
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| Update Date | 2025-03-25 00:47:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164812 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H10N4O3S |
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| Molecular Mass | 242.0474 |
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| SMILES | CC(O)C(O)c1nc2c(=O)[nH]c(=S)[nH]c2[nH]1 |
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| InChI Key | YYMXSVJVJWWPCF-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 | xanthines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-diols2-thiopyrimidinesalkaloids and derivativesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrimidinethionespyrimidonessecondary alcoholsthioureasthioxanthinesvinylogous amides |
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| Substituents | aromatic alcoholthiourealactampyrimidinethionepyrimidoneorganosulfur compoundpyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compound2-thiopyrimidineazole1,2-diolalcoholvinylogous amideazacycleheteroaromatic compoundxanthinethioxanthinealkaloid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundthiopyrimidine |
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