| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:24 UTC |
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| Update Date | 2025-03-21 18:03:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00044307 |
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| Frequency | 76.4 |
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| Structure | |
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| Chemical Formula | C6H11N3O |
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| Molecular Mass | 141.0902 |
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| SMILES | NCC(O)Cn1ccnc1 |
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| InChI Key | IPLIJMUJLJBZDZ-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 | n-substituted imidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundn-substituted imidazole |
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