| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:41 UTC |
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| Update Date | 2025-03-25 00:48:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02170838 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H12BrNO |
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| Molecular Mass | 277.0102 |
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| SMILES | COC(c1ccc(Br)cc1)c1cccnc1 |
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| InChI Key | RKWXCJRTCZSQJZ-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 | benzene and substituted derivatives |
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| Subclass | benzylethers |
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| Direct Parent | benzylethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl bromidesazacyclic compoundsbromobenzenesdialkyl ethersheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganobromidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | etherbenzyletheraromatic heteromonocyclic compoundazacycleheteroaromatic compoundbromobenzenemethylpyridineorganohalogen compounddialkyl etheraryl halidepyridineorganic oxygen compoundorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideorganoheterocyclic compoundorganooxygen compound |
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