| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 00:49:05 UTC |
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| Update Date | 2025-03-21 18:51:15 UTC |
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| HMDB ID | HMDB0243926 |
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| Metabolite Identification |
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| DeepMet ID | DMID00179073 |
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| Name | 1H,3H-Pyrimidine-4-one-2-thione, 1-methyl- |
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| Frequency | 12.9 |
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| Structure | |
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| Chemical Formula | C5H6N2OS |
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| Molecular Mass | 142.0201 |
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| SMILES | Cn1ccc(=O)[nH]c1=S |
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| InChI Key | NHYBHTWIHXJICP-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidinethiones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-thiopyrimidinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidonesthioureasvinylogous amides |
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| Substituents | vinylogous amidethiourealactampyrimidinethionearomatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrimidoneorganosulfur compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compound2-thiopyrimidinehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundthiopyrimidine |
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