| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:04:30 UTC |
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| Update Date | 2025-03-21 18:28:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00072953 |
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| Frequency | 40.9 |
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| Structure | |
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| Chemical Formula | C18H22BrNO |
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| Molecular Mass | 347.0885 |
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| SMILES | CN(C)CCCC(O)(c1ccccc1)c1ccc(Br)cc1 |
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| InChI Key | DEPOXLXXPWJEDV-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 | aromatic alcoholsaryl bromidesbromobenzeneshydrocarbon derivativesorganobromidesorganopnictogen compoundsphenylbutylaminestertiary alcoholstrialkylamines |
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| Substituents | aromatic alcoholalcoholdiphenylmethanetertiary aliphatic aminebromobenzeneorganohalogen compoundaryl halidearomatic homomonocyclic compoundtertiary alcoholphenylbutylamineorganic oxygen compoundorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideaminetertiary amineorganooxygen compound |
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