| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:21 UTC |
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| Update Date | 2025-03-25 00:57:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02227382 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H10N2S |
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| Molecular Mass | 166.0565 |
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| SMILES | C=CCSc1nccc(C)n1 |
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| InChI Key | QUYDMKWGFXTGJW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thioethers |
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| Subclass | aryl thioethers |
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| Direct Parent | aryl thioethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkylarylthioethersallyl sulfur compoundsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspyrimidines and pyrimidine derivativessulfenyl compounds |
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| Substituents | sulfenyl compoundaromatic heteromonocyclic compoundazacycleheteroaromatic compoundallyl sulfur compoundalkylarylthioetheraryl thioetherpyrimidineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compound |
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