| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:42 UTC |
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| Update Date | 2025-03-25 00:56:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219161 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15N3O |
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| Molecular Mass | 205.1215 |
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| SMILES | COc1ccc2nc(CCN)n(C)c2c1 |
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| InChI Key | VQMWCWNEDUBHSW-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 | benzimidazoles |
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| Direct Parent | benzimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesmonoalkylaminesn-substituted imidazolesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | phenol etheretherazacycleheteroaromatic compoundalkyl aryl etherorganic oxygen compoundaromatic heteropolycyclic compoundbenzimidazoleimidazoleanisoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundazolen-substituted imidazole |
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