Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:50:43 UTC |
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Update Date | 2025-03-21 18:02:47 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00040210 |
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Frequency | 86.0 |
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Structure | |
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Chemical Formula | C11H12O3 |
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Molecular Mass | 192.0786 |
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SMILES | CCC(=O)OC(=O)Cc1ccccc1 |
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InChI Key | XWWGBCUGZVFINH-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 | benzene and substituted derivatives |
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Direct Parent | benzene and substituted derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acid anhydridesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxides |
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Substituents | aromatic homomonocyclic compoundmonocyclic benzene moietycarbonyl grouporganic oxideorganic oxygen compoundcarboxylic acid anhydridedicarboxylic acid or derivativeshydrocarbon derivativecarboxylic acid derivativeorganooxygen compound |
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