| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:28 UTC |
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| Update Date | 2025-03-25 00:47:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159019 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H11IO |
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| Molecular Mass | 261.9855 |
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| SMILES | OCCCc1cccc(I)c1 |
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| InChI Key | NYPFFWQKCPNSIJ-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 | halobenzenes |
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| Direct Parent | iodobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alcohols and polyolsaryl iodideshydrocarbon derivativesorganoiodides |
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| Substituents | alcoholorganohalogen compoundiodobenzeneorganoiodidearyl halidearomatic homomonocyclic compoundorganic oxygen compoundhydrocarbon derivativearyl iodideorganooxygen compound |
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