| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:26:43 UTC |
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| Update Date | 2025-03-21 22:18:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00548632 |
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| Frequency | 3.0 |
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| Structure | |
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| Chemical Formula | C5H7N3O |
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| Molecular Mass | 125.0589 |
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| SMILES | NCc1cc(=O)[nH]cn1 |
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| InChI Key | VYOICLJSGPUPPE-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 | pyrimidones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkylaminesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | lactamaromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrimidoneorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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