| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:45 UTC |
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| Update Date | 2025-03-25 00:45:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150570 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14BrNO2 |
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| Molecular Mass | 259.0208 |
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| SMILES | OCCN(CCO)c1ccc(Br)cc1 |
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| InChI Key | PQNNKEVFENCIPW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | dialkylarylamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsalcohols and polyolsaniline and substituted anilinesaryl bromidesbromobenzeneshydrocarbon derivativesorganobromidesorganopnictogen compounds |
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| Substituents | alcoholmonocyclic benzene moiety1,2-aminoalcoholaniline or substituted anilinesbromobenzeneorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxygen compoundorganobromideorganopnictogen compoundhydrocarbon derivativebenzenoidhalobenzenedialkylarylaminearyl bromideorganooxygen compoundalkanolamine |
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