| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:59:44 UTC |
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| Update Date | 2025-03-21 18:55:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00203655 |
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| Frequency | 10.9 |
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| Structure | |
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| Chemical Formula | C6H6N4 |
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| Molecular Mass | 134.0592 |
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| SMILES | Cn1ncc2cncnc21 |
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| InChI Key | MCLXGVNIBMHMNS-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 | pyrazolopyrimidines |
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| Subclass | pyrazolo[3,4-d]pyrimidines |
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| Direct Parent | pyrazolo[3,4-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspyrazolespyrimidines and pyrimidine derivatives |
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| Substituents | pyrazolo[3,4-d]pyrimidineazacycleheteroaromatic compoundpyrazolepyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundazole |
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