| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:03 UTC |
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| Update Date | 2025-03-25 01:00:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02244901 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H24FN3 |
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| Molecular Mass | 337.1954 |
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| SMILES | CN(C)CCCC1(c2ccc(F)cc2)CCNc2cc(C#N)ccc21 |
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| InChI Key | GHDKGMBIKWLWJA-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 | phenylquinolines |
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| Direct Parent | phenylquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl fluoridesazacyclic compoundsfluorobenzeneshydrocarbon derivativeshydroquinolinesnitrilesorganofluoridesorganopnictogen compoundsphenylbutylaminessecondary alkylarylaminestrialkylamines |
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| Substituents | aryl fluoridemonocyclic benzene moietynitrilephenylquinolineorganohalogen compoundfluorobenzenephenylbutylaminearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtetrahydroquinolinecarbonitriletertiary amineazacycleorganofluoridetertiary aliphatic aminesecondary aminesecondary aliphatic/aromatic aminearyl halidehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneamine |
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