| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:50 UTC |
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| Update Date | 2025-03-25 00:45:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150760 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H17BrFN |
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| Molecular Mass | 333.0528 |
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| SMILES | CNC1CCC(c2ccc(Br)c(F)c2)c2ccccc21 |
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| InChI Key | DNETWSURPPOAQN-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | tetralins |
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| Subclass | tametralines |
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| Direct Parent | tametralines |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aryl bromidesaryl fluoridesbromobenzenesdialkylaminesfluorobenzeneshydrocarbon derivativesorganobromidesorganofluoridesorganopnictogen compounds |
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| Substituents | aryl fluoridesecondary aliphatic aminemonocyclic benzene moietyorganofluoridebromobenzenearomatic homopolycyclic compoundsecondary amineorganohalogen compoundaryl halidetametralinefluorobenzeneorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideamine |
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