| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 11:42:04 UTC |
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| Update Date | 2025-03-24 21:18:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01735196 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C4H3N3O2 |
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| Molecular Mass | 125.0225 |
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| SMILES | O=Nc1nccc(=O)[nH]1 |
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| InChI Key | PVJZRSINUZPHST-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 compoundsc-nitroso compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | organic nitroso compoundlactamaromatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrimidoneorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundc-nitroso compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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