| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:02:33 UTC |
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| Update Date | 2025-03-21 18:07:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00068273 |
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| Frequency | 44.4 |
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| Structure | |
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| Chemical Formula | C9H11N3 |
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| Molecular Mass | 161.0953 |
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| SMILES | NCCc1nc2ccccc2[nH]1 |
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| InChI Key | GJEPMYMUORZPMP-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 | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesimidazolesmonoalkylaminesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | azacycleheteroaromatic compoundaromatic heteropolycyclic compoundbenzimidazoleimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundazole |
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