| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:45 UTC |
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| Update Date | 2025-03-25 00:48:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02170995 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H12O4 |
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| Molecular Mass | 196.0736 |
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| SMILES | COC(=O)C(O)COc1ccccc1 |
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| InChI Key | TWKBBKGZPALQOT-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 | phenol ethers |
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| Subclass | phenol ethers |
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| Direct Parent | phenol ethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl etherscarbonyl compoundshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesphenoxy compoundssecondary alcoholssugar acids and derivatives |
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| Substituents | alcoholphenol ethermonocyclic benzene moietycarbonyl groupethermonosaccharidealkyl aryl ethercarboxylic acid derivativearomatic homomonocyclic compoundsaccharideorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundglyceric_acidcarboxylic acid estersecondary alcoholhydrocarbon derivativephenoxy compoundorganooxygen compound |
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