| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:05 UTC |
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| Update Date | 2025-03-25 00:53:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201477 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H24N2O3 |
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| Molecular Mass | 340.1787 |
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| SMILES | C=CC(O)C1CCN2C(C(O)c3ccnc4ccc(OC)cc34)CC12 |
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| InChI Key | YXGKGQKOAVRCIK-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 | 4-quinolinemethanols |
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| Direct Parent | 4-quinolinemethanols |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-aminoalcohols1,3-aminoalcohols2-halopyridinesalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundsazepanesazetidinesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesn-alkylpyrrolidinesorganopnictogen compoundspolyhalopyridinessecondary alcoholstrialkylamines |
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| Substituents | aromatic alcoholphenol etheretherpolyhalopyridinealkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinepyrrolidinetertiary aminealcohol1,3-aminoalcoholazacyclen-alkylpyrrolidine1,2-aminoalcoholheteroaromatic compoundtertiary aliphatic aminehydroxypyridinemethylpyridine4-quinolinemethanolazetidinepyridineazepaneorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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