| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:15 UTC |
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| Update Date | 2025-03-25 01:01:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02249953 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H22O4 |
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| Molecular Mass | 326.1518 |
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| SMILES | COc1cccc(CC2CCOC(=O)C2Cc2cccc(O)c2)c1 |
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| InChI Key | LEPBYWLTGXHJRJ-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 | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl etherscarbonyl compoundscarboxylic acid estersdelta valerolactoneshydrocarbon derivativesmethoxybenzenesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanesphenoxy compounds |
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| Substituents | monocyclic benzene moietycarbonyl groupetheraromatic heteromonocyclic compounddelta valerolactone1-hydroxy-2-unsubstituted benzenoidalkyl aryl ethercarboxylic acid derivativelactoneorganic oxideoxanedelta_valerolactoneorganoheterocyclic compound1-hydroxy-4-unsubstituted benzenoidmethoxybenzeneoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundanisolecarboxylic acid esterphenolhydrocarbon derivativephenoxy compoundorganooxygen compound |
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