| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:52:38 UTC |
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| Update Date | 2025-03-21 18:03:32 UTC |
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| HMDB ID | HMDB0303508 |
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| Metabolite Identification |
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| DeepMet ID | DMID00044868 |
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| Name | 4,4'-Dihydroxy-3,3'-dimethoxy-9,9'-epoxylignan |
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| Frequency | 75.3 |
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| Structure | |
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| Chemical Formula | C20H24O5 |
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| Molecular Mass | 344.1624 |
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| SMILES | COc1cc(CC2COCC2Cc2ccc(O)c(OC)c2)ccc1O |
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| InChI Key | ROGUIJKVZZROIQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lignans, neolignans and related compounds |
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| Class | furanoid lignans |
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| Subclass | tetrahydrofuran lignans |
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| Direct Parent | 9,9'-epoxylignans |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesdialkyl ethershydrocarbon derivativesmethoxybenzenesmethoxyphenolsoxacyclic compoundsphenoxy compoundstetrahydrofurans |
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| Substituents | phenol ethermonocyclic benzene moietyetheraromatic heteromonocyclic compoundtetrahydrofuran1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl ethermethoxybenzenedialkyl etheroxacycleorganic oxygen compoundanisolephenol9,9p-epoxylignanhydrocarbon derivativebenzenoidphenoxy compoundorganoheterocyclic compoundorganooxygen compound |
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