| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:39:24 UTC |
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| Update Date | 2025-03-25 00:46:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02154466 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H24O6 |
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| Molecular Mass | 360.1573 |
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| SMILES | COc1cc(CC(CO)C(CO)CC(=O)c2ccc(O)cc2)ccc1O |
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| InChI Key | MGOYTIYBRCDTLV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alkyl-phenylketones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl alkyl ketonesbenzoyl derivativesbutyrophenonesfatty alcoholshydrocarbon derivativesmethoxybenzenesmethoxyphenolsorganic oxidesphenoxy compoundsprimary alcohols |
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| Substituents | fatty acylphenol ethermonocyclic benzene moietyetheraryl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherorganic oxidefatty alcoholprimary alcoholalcoholmethoxybenzenebutyrophenonearomatic homomonocyclic compoundanisolephenolhydrocarbon derivativebenzenoidphenoxy compoundalkyl-phenylketone |
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