| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:07 UTC |
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| Update Date | 2025-03-21 18:07:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00069639 |
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| Frequency | 43.3 |
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| Structure | |
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| Chemical Formula | C7H5N3O2 |
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| Molecular Mass | 163.0382 |
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| SMILES | O=c1[nH]c(=O)c2ccncc2[nH]1 |
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| InChI Key | MNNWQAIAFUMNOS-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 | pyridopyrimidines |
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| Subclass | pyrido[3,4-d]pyrimidines |
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| Direct Parent | pyrido[3,4-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivativespyrimidonesvinylogous amides |
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| Substituents | vinylogous amidecarbonic acid derivativepyrido[3,4-d]pyrimidinelactamazacyclepolyhalopyridineheteroaromatic compoundpyrimidonepyrimidineorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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