| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:23 UTC |
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| Update Date | 2025-03-25 00:56:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218421 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14N6S |
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| Molecular Mass | 238.1001 |
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| SMILES | CNc1nc2c(NCCSC)ncnc2[nH]1 |
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| InChI Key | ISRGRVKWSOWFLR-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 | azacyclic compoundsdialkylthioethersheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsorganopnictogen compoundspyrimidines and pyrimidine derivativessecondary alkylarylaminessulfenyl compounds |
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| Substituents | sulfenyl compoundazacycledialkylthioetherheteroaromatic compoundsecondary amineorganosulfur compoundsecondary aliphatic/aromatic aminepyrimidinearomatic heteropolycyclic compoundthioetherimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepurineorganic nitrogen compoundimidolactamamineazole |
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