Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:49:52 UTC |
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Update Date | 2025-03-25 00:50:01 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02178230 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C12H11N5O |
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Molecular Mass | 241.0964 |
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SMILES | Cn1c(-c2ccccc2)nc2c(N)nc(=O)[nH]c21 |
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InChI Key | YJYZNISMMZCJAL-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 | phenylimidazoles |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | azacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespurinonespyrimidones |
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Substituents | monocyclic benzene moietypyrimidoneimidazopyrimidinepurinonepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundimidolactamn-substituted imidazolecarbonic acid derivativeazacycleheteroaromatic compoundorganic oxygen compound2-phenylimidazolehydrocarbon derivativebenzenoidpurineprimary amineorganic nitrogen compoundamineorganooxygen compound |
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