| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:30 UTC |
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| Update Date | 2025-03-21 18:36:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00109124 |
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| Frequency | 50.2 |
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| Structure | |
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| Chemical Formula | C4H5N3S |
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| Molecular Mass | 127.0204 |
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| SMILES | Nc1ccnc(=S)[nH]1 |
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| InChI Key | DCPSTSVLRXOYGS-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 derivativesorganopnictogen compoundsorganosulfur compoundsprimary amines |
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| Substituents | pyrimidinethionearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganosulfur compoundorganonitrogen compoundorganopnictogen compound2-thiopyrimidinehydrocarbon derivativeprimary amineorganic nitrogen compoundaminethiopyrimidine |
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