| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:33 UTC |
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| Update Date | 2025-03-21 18:33:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00096951 |
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| Frequency | 28.5 |
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| Structure | |
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| Chemical Formula | C18H22BrNO2 |
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| Molecular Mass | 363.0834 |
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| SMILES | COc1cc(C(CCN(C)C)c2ccc(Br)cc2)ccc1O |
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| InChI Key | AUIMQPJFTFCURQ-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 | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl bromidesbromobenzeneshydrocarbon derivativesmethoxybenzenesmethoxyphenolsorganobromidesorganopnictogen compoundsphenoxy compoundstrialkylamines |
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| Substituents | diphenylmethanephenol etherether1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherorganohalogen compoundorganonitrogen compoundorganopnictogen compoundtertiary aminetertiary aliphatic aminebromobenzenemethoxybenzenearyl halidearomatic homomonocyclic compoundorganic oxygen compoundanisoleorganobromidephenolhydrocarbon derivativeorganic nitrogen compoundhalobenzenephenoxy compoundaryl bromideamineorganooxygen compound |
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