| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:37 UTC |
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| Update Date | 2025-03-21 18:07:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00068439 |
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| Frequency | 59.4 |
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| Structure | |
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| Chemical Formula | C14H12N2O |
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| Molecular Mass | 224.095 |
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| SMILES | COc1ccc2nc(-c3ccccc3)[nH]c2c1 |
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| InChI Key | SMHBLCFXCWISPZ-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 | benzimidazoles |
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| Subclass | phenylbenzimidazoles |
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| Direct Parent | phenylbenzimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesorganonitrogen compoundsorganopnictogen compoundsphenylimidazoles |
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| Substituents | phenol ethermonocyclic benzene moietyetherazacycleheteroaromatic compoundalkyl aryl etherorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleanisole2-phenylimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundazolephenylbenzimidazole |
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