| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:59:43 UTC |
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| Update Date | 2025-03-24 20:58:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01632990 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C5H6N4O |
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| Molecular Mass | 138.0542 |
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| SMILES | Cn1c(N)c(C#N)[nH]c1=O |
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| InChI Key | MMKNYDYWRQLOJW-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 | azoles |
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| Subclass | imidazoles |
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| Direct Parent | n-substituted imidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesnitrilesorganic carbonic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary amines |
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| Substituents | carbonic acid derivativenitrilearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundaminecarbonitrileorganooxygen compoundn-substituted imidazole |
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