| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:17:42 UTC |
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| Update Date | 2025-03-21 18:35:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00104712 |
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| Frequency | 25.9 |
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| Structure | |
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| Chemical Formula | C26H27BrClNO |
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| Molecular Mass | 483.0965 |
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| SMILES | OC1(c2ccc(Cl)cc2)CCN(CCC(c2ccccc2)c2ccc(Br)cc2)CC1 |
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| InChI Key | ZWLHMSLBLSSFMJ-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 | aryl bromidesaryl chloridesazacyclic compoundsbromobenzeneschlorobenzeneshydrocarbon derivativesorganobromidesorganochloridesorganopnictogen compoundsphenylpiperidinestertiary alcoholstrialkylamines |
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| Substituents | diphenylmethanearomatic heteromonocyclic compoundorganochlorideorganohalogen compoundorganonitrogen compoundorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundaryl chloridechlorobenzenealcoholazacycletertiary aliphatic aminebromobenzenearyl halidetertiary alcoholorganic oxygen compoundphenylpiperidineorganobromidehydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideamineorganooxygen compound |
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