| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:06 UTC |
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| Update Date | 2025-03-25 00:50:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183266 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H14BrNO |
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| Molecular Mass | 339.0259 |
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| SMILES | OC(c1ccccc1)(c1ccc(Br)cc1)c1ccccn1 |
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| InChI Key | OEWTZURLJLKACG-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 | diphenylmethanes |
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| Direct Parent | diphenylmethanes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaromatic alcoholsaryl bromidesazacyclic compoundsbromobenzenesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganobromidesorganonitrogen compoundsorganopnictogen compoundstertiary alcohols |
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| Substituents | aromatic alcoholdiphenylmethanearomatic heteromonocyclic compoundorganohalogen compoundorganonitrogen compoundorganopnictogen compound2-halopyridineorganoheterocyclic compoundalcoholazacycleheteroaromatic compoundhydroxypyridinebromobenzenearyl halidetertiary alcoholpyridineorganic oxygen compoundorganobromidehydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideorganooxygen compound |
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