| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:19 UTC |
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| Update Date | 2025-03-25 00:50:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179222 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14N4O3S3 |
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| Molecular Mass | 310.0228 |
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| SMILES | CSc1ncc(CSCCC(N)=NS(N)(=O)=O)o1 |
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| InChI Key | BRHOLSIQNHKBLO-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 | 2,5-disubstituted oxazolesalkylarylthioethersamidinesazacyclic compoundsdialkylthioethersheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganic sulfuric acids and derivativesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundssulfenyl compounds |
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| Substituents | organic sulfuric acid or derivativessulfenyl compoundaromatic heteromonocyclic compoundazacycledialkylthioetherheteroaromatic compoundoxazoleamidinealkylarylthioether2,5-disubstituted 1,3-oxazolearyl thioetheroxacycleorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundazole |
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