| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:15 UTC |
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| Update Date | 2025-03-21 17:58:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00015962 |
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| Frequency | 270.0 |
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| Structure | |
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| Chemical Formula | C9H8O4 |
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| Molecular Mass | 180.0423 |
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| SMILES | COc1ccc(C(=O)C(=O)O)cc1 |
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| InChI Key | IDTFANFXLFNLMC-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 | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersalpha-keto acids and derivativesaryl ketonesbenzoyl derivativescarboxylic acidshydrocarbon derivativesmethoxybenzenesmonocarboxylic acids and derivativesorganic oxidesphenoxy compounds |
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| Substituents | monocyclic benzene moietycarbonyl groupethercarboxylic acidbenzoylalkyl aryl ethercarboxylic acid derivativemethoxybenzeneketonearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundanisoleketo acidalpha-keto acidhydrocarbon derivativephenoxy compoundorganooxygen compoundaryl ketone |
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