| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:23:12 UTC |
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| Update Date | 2025-03-21 18:37:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00118133 |
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| Frequency | 53.6 |
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| Structure | |
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| Chemical Formula | C7H6N4O2 |
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| Molecular Mass | 178.0491 |
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| SMILES | Cn1cnc2[nH]cnc(=O)c2c1=O |
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| InChI Key | JCTLAYXYPRUEGM-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 derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidelactamazacycleheteroaromatic compoundpyrimidoneorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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