Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:34 UTC |
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Update Date | 2025-03-21 18:35:11 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00104375 |
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Frequency | 26.0 |
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Structure | |
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Chemical Formula | C18H26O4 |
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Molecular Mass | 306.1831 |
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SMILES | CCCCCCOC(=O)c1ccccc1C(=O)OCC(C)C |
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InChI Key | MWCVIAUQQRKEAM-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 | benzoyl derivativescarboxylic acid estersdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganooxygen compounds |
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Substituents | benzoylbenzoate estercarboxylic acid derivativearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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