| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:42 UTC |
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| Update Date | 2025-03-25 00:45:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150434 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8INO3 |
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| Molecular Mass | 292.9549 |
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| SMILES | COc1cc(C(N)=O)cc(I)c1O |
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| InChI Key | MAMKHMVEDOCHDE-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 | phenols |
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| Subclass | methoxyphenols |
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| Direct Parent | methoxyphenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 3-halobenzoic acids and derivativesalkyl aryl ethersanisolesaryl iodidesbenzamidesbenzoyl derivativescarboxylic acids and derivativeshalophenolshydrocarbon derivativesiodobenzenesmethoxybenzeneso-iodophenolsorganic oxidesorganoiodidesorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundsprimary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidephenol ethermonocyclic benzene moietyether3-halobenzoic acid or derivativesbenzoylmethoxyphenolalkyl aryl ethercarboxylic acid derivativeorganohalogen compoundiodobenzenebenzamideorganoiodideorganic oxideorganonitrogen compoundorganopnictogen compound2-iodophenolbenzoic acid or derivativeshalobenzoic acid or derivativescarboxamide groupmethoxybenzenearyl halidearomatic homomonocyclic compound2-halophenolorganic oxygen compoundanisolehydrocarbon derivativearyl iodideorganic nitrogen compoundhalobenzenephenoxy compoundorganooxygen compound |
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