| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:30:30 UTC |
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| Update Date | 2025-03-21 18:41:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00135190 |
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| Frequency | 18.6 |
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| Structure | |
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| Chemical Formula | C7H7N3 |
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| Molecular Mass | 133.064 |
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| SMILES | Cn1ccc2cncnc21 |
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| InChI Key | XDTQCCMRBSYSAO-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 | pyrrolopyrimidines |
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| Subclass | pyrrolo[2,3-d]pyrimidines |
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| Direct Parent | pyrrolo[2,3-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesn-methylpyrrolesorganonitrogen compoundsorganopnictogen compoundspyrimidines and pyrimidine derivativessubstituted pyrroles |
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| Substituents | n-methylpyrroleazacycleheteroaromatic compoundsubstituted pyrrolepyrimidinepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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