| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:07 UTC |
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| Update Date | 2025-03-21 18:02:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041192 |
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| Frequency | 98.9 |
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| Structure | |
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| Chemical Formula | C9H10N2OS |
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| Molecular Mass | 194.0514 |
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| SMILES | COc1ccc2nc(SC)[nH]c2c1 |
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| InChI Key | PWMHKUVMHMOAIF-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 | benzimidazoles |
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| Subclass | benzimidazoles |
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| Direct Parent | benzimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersalkylarylthioethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compoundssulfenyl compounds |
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| Substituents | phenol etherethersulfenyl compoundazacycleheteroaromatic compoundalkyl aryl etheralkylarylthioetherorganosulfur compoundaryl thioetherorganic oxygen compoundaromatic heteropolycyclic compoundthioetherbenzimidazoleimidazoleanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundazole |
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