| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:01 UTC |
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| Update Date | 2025-03-25 00:54:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02208174 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H15BrO2 |
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| Molecular Mass | 318.0255 |
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| SMILES | CC(CC(=O)O)(c1ccccc1)c1ccc(Br)cc1 |
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| InChI Key | WBGBFZIRGLXFML-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 bromidesbromobenzenescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganobromidesphenylpropanoic acids |
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| Substituents | diphenylmethanecarbonyl groupcarboxylic acid3-phenylpropanoic-acidbromobenzenecarboxylic acid derivativeorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganobromidehydrocarbon derivativehalobenzenearyl bromideorganooxygen compound |
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