| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:06 UTC |
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| Update Date | 2025-03-25 00:55:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02210786 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H12N2O |
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| Molecular Mass | 200.095 |
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| SMILES | C=CCNc1ccnc2ccc(O)cc12 |
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| InChI Key | YXXUBCLMXCYJQS-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 | hydroxyquinolines |
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| Direct Parent | hydroxyquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganooxygen compoundsorganopnictogen compoundspolyhalopyridinessecondary alkylarylamines |
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| Substituents | azacyclepolyhalopyridineheteroaromatic compoundhydroxypyridine1-hydroxy-2-unsubstituted benzenoidsecondary aminesecondary aliphatic/aromatic aminehydroxyquinolinepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundamineorganooxygen compound |
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