| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:34 UTC |
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| Update Date | 2025-03-21 18:02:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037528 |
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| Frequency | 93.8 |
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| Structure | |
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| Chemical Formula | C19H21BrN2 |
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| Molecular Mass | 356.0888 |
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| SMILES | CN(C)CCC(c1ccc(Br)cc1)c1c[nH]c2ccccc12 |
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| InChI Key | XUTASRZRLBCTNP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl bromidesazacyclic compoundsbromobenzenesheteroaromatic compoundshydrocarbon derivativesorganobromidesorganopnictogen compoundspyrrolestrialkylamines |
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| Substituents | monocyclic benzene moietyazacycleindoleheteroaromatic compoundtertiary aliphatic aminebromobenzeneorganohalogen compoundaryl halidearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzenearyl bromideaminetertiary amine |
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