| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:16 UTC |
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| Update Date | 2025-03-25 00:46:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158580 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C26H28BrNO |
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| Molecular Mass | 449.1354 |
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| SMILES | OC(c1ccccc1)(c1ccccc1)C1CCN(CCc2ccc(Br)cc2)CC1 |
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| InChI Key | JBOWFXLCZJFTBF-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 | aromatic alcoholsaryl bromidesazacyclic compoundsbromobenzeneshydrocarbon derivativesorganobromidesorganopnictogen compoundsphenethylaminespiperidinestertiary alcoholstrialkylamines |
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| Substituents | aromatic alcoholdiphenylmethanearomatic heteromonocyclic compoundphenethylamineorganohalogen compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundalcoholazacycletertiary aliphatic aminebromobenzenearyl halidetertiary alcoholorganic oxygen compoundorganobromidehydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideamineorganooxygen compound |
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