| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:17 UTC |
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| Update Date | 2025-03-21 18:04:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00048802 |
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| Frequency | 67.8 |
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| Structure | |
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| Chemical Formula | C17H21BrN2 |
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| Molecular Mass | 332.0888 |
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| SMILES | Cc1cccnc1C(CCN(C)C)c1ccc(Br)cc1 |
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| InChI Key | VBZSAJMHPYQLHN-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 | pyridines and derivatives |
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| Subclass | pheniramines |
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| Direct Parent | pheniramines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl bromidesazacyclic compoundsbromobenzenesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganobromidesorganopnictogen compoundspolyhalopyridinestrialkylamines |
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| Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundpheniraminepolyhalopyridineorganohalogen compoundorganonitrogen compoundorganopnictogen compound2-halopyridinetertiary amineazacycleheteroaromatic compoundtertiary aliphatic aminebromobenzenemethylpyridinearyl halideorganobromidehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenearyl bromideamine |
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