| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:54 UTC |
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| Update Date | 2025-03-25 00:48:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02166846 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H11IO2 |
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| Molecular Mass | 289.9804 |
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| SMILES | CC(C)(C(=O)O)c1ccc(I)cc1 |
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| InChI Key | LUOOAPSBQSYYND-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 | phenylpropanes |
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| Direct Parent | phenylpropanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl iodidescarbonyl compoundscarboxylic acidshydrocarbon derivativesiodobenzenesmonocarboxylic acids and derivativesorganic oxidesorganoiodides |
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| Substituents | carbonyl groupcarboxylic acidcarboxylic acid derivativeorganohalogen compoundiodobenzeneorganoiodidearyl halidephenylpropanearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativearyl iodidehalobenzeneorganooxygen compound |
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