| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:50:26 UTC |
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| Update Date | 2025-03-21 18:51:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00182339 |
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| Frequency | 12.6 |
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| Structure | |
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| Chemical Formula | C4H5N3O |
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| Molecular Mass | 111.0433 |
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| SMILES | Cc1nc[nH]c(=O)n1 |
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| InChI Key | BJKQHBBCZYBADF-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 | triazines |
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| Subclass | triazinones |
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| Direct Parent | triazinones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundshalo-s-triazinesheteroaromatic compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | carbonic acid derivativearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundhalo-s-triazineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1,3,5-triazineorganic nitrogen compoundtriazinoneorganooxygen compound |
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