| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:05:11 UTC |
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| Update Date | 2025-03-25 00:55:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02213374 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H20N2O3 |
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| Molecular Mass | 312.1474 |
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| SMILES | C=CC12CCC(C(O)c3ccnc4ccc(OC)cc34)N(C1)O2 |
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| InChI Key | KKLOSTFHXBKQBY-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-oxazinanes2-halopyridinesalkyl aryl ethersanisolesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesn-organohydroxylaminesorganopnictogen compoundsoxacyclic compoundspiperidinespolyhalopyridinessecondary alcohols |
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| Substituents | aromatic alcoholphenol etheretherpolyhalopyridinealkyl aryl ether1,2-oxazinanearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinepiperidinealcoholazacycleheteroaromatic compoundhydroxypyridinemethylpyridine4-quinolinemethanoln-organohydroxylamineoxazinaneoxacyclepyridineorganic oxygen compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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