| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:37 UTC |
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| Update Date | 2025-03-25 00:45:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02152572 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H14N4O2S |
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| Molecular Mass | 266.0837 |
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| SMILES | C=CCSc1nc2c(c(=O)n(C)c(=O)n2C)n1C |
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| InChI Key | XAAHYFZAUOPMKP-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 | alkylarylthioethersallyl sulfur compoundsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonessulfenyl compoundsureasvinylogous amides |
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| Substituents | lactamallyl sulfur compoundpyrimidonealkylarylthioetherorganosulfur compoundaryl thioetherpurinonepyrimidineureaorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolen-substituted imidazolevinylogous amidecarbonic acid derivativesulfenyl compoundazacycleheteroaromatic compoundorganic oxygen compoundthioetherhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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