| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:17 UTC |
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| Update Date | 2025-03-21 18:02:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00039215 |
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| Frequency | 88.9 |
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| Structure | |
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| Chemical Formula | C15H12N2 |
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| Molecular Mass | 220.1 |
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| SMILES | c1ccc(Nc2ccnc3ccccc23)cc1 |
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| InChI Key | NRTUTGBOQZQBMB-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 compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundspolyhalopyridinespyridines and derivativessecondary amines |
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| Substituents | monocyclic benzene moietyazacyclepolyhalopyridineheteroaromatic compoundsecondary aminepyridinearomatic heteropolycyclic compoundorganonitrogen compoundquinolineorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundamine |
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