| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:17 UTC |
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| Update Date | 2025-03-25 00:56:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218181 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H9N7 |
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| Molecular Mass | 263.0919 |
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| SMILES | N#Cc1ccc(-c2cnc3nc(N)nc(N)c3n2)cc1 |
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| InChI Key | OGGVMESXRAQASG-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 | pteridines and derivatives |
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| Subclass | pteridines and derivatives |
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| Direct Parent | pteridines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzonitrilesheteroaromatic compoundshydrocarbon derivativesimidolactamsnitrilesorganopnictogen compoundsprimary aminespyrazinespyrimidines and pyrimidine derivatives |
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| Substituents | monocyclic benzene moietynitrileazacycleheteroaromatic compoundpteridinebenzonitrilepyrimidinearomatic heteropolycyclic compoundpyrazineorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidprimary amineorganic nitrogen compoundimidolactamaminecarbonitrile |
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