| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:01 UTC |
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| Update Date | 2025-03-25 00:49:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171615 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C21H21BrN2 |
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| Molecular Mass | 380.0888 |
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| SMILES | CN(CCC(c1ccc(Br)cc1)c1ccccn1)c1ccccc1 |
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| InChI Key | OFIYHDNTUAJWFL-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-halopyridinesaniline and substituted anilinesaryl bromidesazacyclic compoundsbromobenzenesdialkylarylaminesheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganobromidesorganopnictogen compounds |
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| Substituents | monocyclic benzene moietyaromatic heteromonocyclic compoundpheniramineorganohalogen compoundtertiary aliphatic/aromatic amineorganonitrogen compoundorganopnictogen compound2-halopyridinedialkylarylaminetertiary amineazacycleaniline or substituted anilinesheteroaromatic compoundbromobenzenemethylpyridinearyl halideorganobromidehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenearyl bromideamine |
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