| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:43:23 UTC |
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| Update Date | 2025-03-21 17:59:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00022885 |
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| Frequency | 172.8 |
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| Structure | |
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| Chemical Formula | C19H18O7 |
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| Molecular Mass | 358.1053 |
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| SMILES | Oc1cc(C2OCC3C(c4ccc5c(c4)OCO5)OCC23)cc(O)c1O |
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| InChI Key | CWFMCRLFHTVZRS-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 | furan lignans |
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| Direct Parent | furan lignans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalsbenzene and substituted derivativesbenzodioxolesdialkyl ethersfurofuran lignansfurofuranshydrocarbon derivativesoxacyclic compoundspyrogallols and derivativestetrahydrofurans |
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| Substituents | monocyclic benzene moietyetherpyrogallol derivativefurofuran lignan skeletontetrahydrofuranbenzenetriol1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoiddialkyl etheroxacyclefuran lignan skeletonorganic oxygen compoundacetalaromatic heteropolycyclic compoundfurofuranphenolhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compoundbenzodioxole |
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