| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:47 UTC |
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| Update Date | 2025-03-25 00:59:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235135 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H7ClN4O3 |
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| Molecular Mass | 278.0207 |
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| SMILES | O=c1[nH]c(=O)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c2[nH]1 |
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| InChI Key | WSURXXZRIHEJDE-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 | aryl chloridesazacyclic compoundschlorobenzenesheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspurinonespyrimidonesvinylogous amides |
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| Substituents | monocyclic benzene moietylactamorganochloridepyrimidoneimidazopyrimidineorganohalogen compoundpurinonepyrimidine1-phenylimidazoleorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundn-substituted imidazolearyl chloridechlorobenzenevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundaryl halideorganic oxygen compoundhydrocarbon derivativebenzenoidpurineorganic nitrogen compoundhalobenzeneorganooxygen compound |
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