| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:33:23 UTC |
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| Update Date | 2025-03-24 17:52:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00994650 |
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| Frequency | 1.4 |
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| Structure | |
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| Chemical Formula | C8H7N3 |
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| Molecular Mass | 145.064 |
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| SMILES | Cc1nccc2cncnc12 |
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| InChI Key | QNBWADFXYBRPBF-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 | 2-halopyridinesazacyclic 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 derivative2-halopyridineorganic nitrogen compound |
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