| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:14 UTC |
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| Update Date | 2025-03-25 00:56:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220403 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H8N4S |
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| Molecular Mass | 180.047 |
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| SMILES | CSc1ncc2c(ncn2C)n1 |
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| InChI Key | CVQHWHLUVJTHFZ-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 | purines and purine derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkylarylthioethersazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesn-substituted imidazolesorganonitrogen compoundsorganopnictogen compoundspyrimidines and pyrimidine derivativessulfenyl compounds |
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| Substituents | sulfenyl compoundazacycleheteroaromatic compoundalkylarylthioetherorganosulfur compoundaryl thioetherpyrimidinearomatic heteropolycyclic compoundthioetherimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepurineorganic nitrogen compoundazolen-substituted imidazole |
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