| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:32 UTC |
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| Update Date | 2025-03-25 00:47:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159168 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H25N3O3 |
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| Molecular Mass | 367.1896 |
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| SMILES | OCCOCCN1CCN(c2nc3ccc(O)cc3c3ccccc23)CC1 |
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| InChI Key | VVRIMBACVVIIBW-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 | benzoquinolines |
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| Direct Parent | phenanthridines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesalcohols and polyolsaminopyridines and derivativesaminoquinolines and derivativesazacyclic compoundsbenzenoidsdialkyl ethersdialkylarylaminesheteroaromatic compoundshydrocarbon derivativeshydroxypyridineshydroxyquinolinesimidolactamsisoquinolines and derivativesn-alkylpiperazinesn-arylpiperazinesorganopnictogen compoundspolyhalopyridinespyridinylpiperazinestrialkylamines |
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| Substituents | etherpolyhalopyridine1-hydroxy-2-unsubstituted benzenoiddialkyl etherpiperazinearomatic heteropolycyclic compoundpyridinylpiperazineorganonitrogen compoundorganopnictogen compound2-halopyridinedialkylarylamineimidolactamaminopyridinetertiary aminealcoholazacyclen-alkylpiperazineheteroaromatic compoundtertiary aliphatic aminehydroxypyridinehydroxyquinolinepyridineorganic oxygen compound1,4-diazinaneaminoquinolineisoquinolinehydrocarbon derivativebenzenoidphenanthridineorganic nitrogen compoundaminen-arylpiperazineorganooxygen compound |
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