| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:22:30 UTC |
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| Update Date | 2025-03-21 18:37:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00116390 |
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| Frequency | 22.6 |
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| Structure | |
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| Chemical Formula | C13H17N3 |
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| Molecular Mass | 215.1422 |
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| SMILES | NCCCCNc1ccnc2ccccc12 |
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| InChI Key | DQBUXZKYRIJWKO-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 | quinolines and derivatives |
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| Subclass | quinolines and derivatives |
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| Direct Parent | quinolines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganopnictogen compoundspolyhalopyridinespyridines and derivativessecondary alkylarylamines |
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| Substituents | azacyclepolyhalopyridineheteroaromatic compoundsecondary aminesecondary aliphatic/aromatic aminepyridinearomatic heteropolycyclic compoundorganonitrogen compoundquinolineorganopnictogen compoundhydrocarbon derivativebenzenoidprimary aliphatic amine2-halopyridineorganic nitrogen compoundamine |
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