| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:54 UTC |
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| Update Date | 2025-03-25 00:59:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235396 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C17H26O2 |
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| Molecular Mass | 262.1933 |
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| SMILES | Cc1ccc(C)c(C(C)C)c1C(=O)OCC(C)(C)C |
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| InChI Key | OVKMZRLQTWVPTJ-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 esterscumeneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsphenylpropanesp-xylenes |
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| Substituents | benzoylbenzoate estercarboxylic acid derivativephenylpropanearomatic homomonocyclic compoundxyleneorganic oxidemonocarboxylic acid or derivativesp-xyleneorganic oxygen compoundcarboxylic acid estercumenehydrocarbon derivativeorganooxygen compound |
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