| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:04:59 UTC |
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| Update Date | 2025-03-21 19:03:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00215946 |
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| Frequency | 10.1 |
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| Structure | |
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| Chemical Formula | C7H5N3 |
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| Molecular Mass | 131.0483 |
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| SMILES | c1cc2cncnc2cn1 |
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| InChI Key | PAQYIEZTLSDLQO-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 derivativesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridines and derivativespyrimidines and pyrimidine derivatives |
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| Substituents | pyrido[3,4-d]pyrimidineazacyclepolyhalopyridineheteroaromatic compoundpyrimidinepyridinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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