Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:19:46 UTC |
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Update Date | 2025-03-21 18:36:17 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00109803 |
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Frequency | 24.3 |
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Structure | |
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Chemical Formula | C18H18O4 |
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Molecular Mass | 298.1205 |
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SMILES | CC(COC(=O)c1ccccc1C(=O)O)Cc1ccccc1 |
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InChI Key | BJZOFZCPCMMXJT-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 | benzoic acids and derivatives |
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Direct Parent | benzoic acid esters |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-carboxy-2-haloaromatic compoundsbenzoic acidsbenzoyl derivativescarboxylic acid estersdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsphenylpropanes |
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Substituents | carboxylic acidbenzoylbenzoate estercarboxylic acid derivativephenylpropanearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivative1-carboxy-2-haloaromatic compoundbenzoic acidorganooxygen compound |
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