| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:12 UTC |
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| Update Date | 2025-03-25 00:45:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151595 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H6N4O2 |
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| Molecular Mass | 166.0491 |
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| SMILES | Cc1onc2[nH]c(N)nc(=O)c12 |
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| InChI Key | RDGDBTDKAMSTIC-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 heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesisoxazolesorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsprimary aminesvinylogous amides |
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| Substituents | vinylogous amideazacycleheteroaromatic compoundisoxazolepyrimidoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compoundazole |
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