| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:25 UTC |
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| Update Date | 2025-03-25 00:45:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02149781 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H9N5OS |
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| Molecular Mass | 199.0528 |
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| SMILES | N=C(N)NCc1cc(=O)[nH]c(=S)[nH]1 |
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| InChI Key | NBCRFGHGDNLAJZ-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 compoundscarboximidamidesguanidinesheteroaromatic compoundshydrocarbon derivativesimineslactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundspyrimidonesthioureasvinylogous amides |
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| Substituents | vinylogous amidethiourealactampyrimidinethionearomatic heteromonocyclic compoundazacycleguanidineimineheteroaromatic compoundpyrimidonecarboximidamideorganosulfur compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compound2-thiopyrimidinehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundthiopyrimidine |
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