| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:34 UTC |
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| Update Date | 2025-03-25 00:53:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02197915 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C25H40O4 |
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| Molecular Mass | 404.2927 |
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| SMILES | CCCCCCCCCCCCCC(=O)COC(C)c1ccccc1C(=O)OC |
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| InChI Key | CZVJOAOMTROYQX-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 derivativesbenzylethersdialkyl ethershydrocarbon derivativesketonesmethyl estersmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | carbonyl groupetherbenzyletherbenzoylbenzoate estercarboxylic acid derivativedialkyl etherketonearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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