| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:51 UTC |
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| Update Date | 2025-03-21 18:04:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00050170 |
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| Frequency | 65.5 |
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| Structure | |
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| Chemical Formula | C18H20O3 |
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| Molecular Mass | 284.1412 |
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| SMILES | Oc1cccc(CC2COCC2Cc2cccc(O)c2)c1 |
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| InChI Key | LLQYBPNZHZFNDC-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 benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativesdialkyl ethershydrocarbon derivativesoxacyclic compoundstetrahydrofurans |
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| Substituents | monocyclic benzene moietyetheraromatic heteromonocyclic compoundtetrahydrofuran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoiddialkyl etheroxacycleorganic oxygen compoundphenol9,9p-epoxylignanhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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