| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:31:06 UTC |
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| Update Date | 2025-03-24 22:15:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01132472 |
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| Frequency | 1.2 |
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| Structure | |
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| Chemical Formula | C7H4N4 |
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| Molecular Mass | 144.0436 |
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| SMILES | N#Cc1c[nH]c2ncncc12 |
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| InChI Key | GDYUNCUMRKXRHY-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 derivativesnitrilesorganonitrogen compoundsorganopnictogen compoundspyrimidines and pyrimidine derivativespyrroles |
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| Substituents | nitrileazacycleheteroaromatic compoundpyrimidinepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundcarbonitrile |
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