| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:25 UTC |
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| Update Date | 2025-03-25 01:00:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245777 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H32O6 |
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| Molecular Mass | 392.2199 |
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| SMILES | CC1CCC(=O)OC1Cc1cccc(OC2OC(C(O)O)C(C)C(C)C2C)c1 |
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| InChI Key | PHNUKEGVXGHXDN-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 | phenol ethers |
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| Direct Parent | phenol ethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetalscarbonyl compoundscarbonyl hydratescarboxylic acid estersdelta valerolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxanesphenoxy compounds |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupcarbonyl hydratearomatic heteromonocyclic compounddelta valerolactonecarboxylic acid derivativelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundacetalcarboxylic acid esterhydrocarbon derivativephenoxy compoundoxanedelta_valerolactoneorganoheterocyclic compoundorganooxygen compound |
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