Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:22:29 UTC |
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Update Date | 2025-03-21 18:37:35 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00116349 |
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Frequency | 22.6 |
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Structure | |
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Chemical Formula | C19H30O3 |
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Molecular Mass | 306.2195 |
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SMILES | CC(C)(C)OC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 |
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InChI Key | GNDAQFKLKWVNPL-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 | p-hydroxybenzoic acid alkyl esters |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | benzoyl derivativescarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsphenolsphenylpropanes |
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Substituents | benzoylcarboxylic acid derivativep-hydroxybenzoic acid alkyl esterphenylpropanearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterphenolhydrocarbon derivativeorganooxygen compound |
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