| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:07 UTC |
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| Update Date | 2025-03-25 00:49:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02171852 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H22BrNO2S |
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| Molecular Mass | 395.0555 |
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| SMILES | CN(C)CCC(c1ccc(Br)cc1)c1ccc(S(C)(=O)=O)cc1 |
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| InChI Key | VJKGEFNXXGOMIF-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 homomonocyclic compounds |
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| Alternative Parents | aryl bromidesbenzenesulfonyl compoundsbromobenzeneshydrocarbon derivativesorganic oxidesorganobromidesorganopnictogen compoundssulfonestrialkylamines |
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| Substituents | diphenylmethanetertiary aliphatic aminebromobenzeneorganosulfur compoundorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideaminetertiary aminesulfonebenzenesulfonyl group |
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