| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:58 UTC |
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| Update Date | 2025-03-21 17:57:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00006042 |
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| Frequency | 866.8 |
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| Structure | |
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| Chemical Formula | C18H18O6 |
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| Molecular Mass | 330.1103 |
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| SMILES | Oc1ccc(C2OCC3C(c4ccc(O)c(O)c4)OCC23)cc1O |
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| InChI Key | OQSOTSIYXPYTRE-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 benzenoidsbenzene and substituted derivativesdialkyl ethersfurofuran lignansfurofuranshydrocarbon derivativesoxacyclic compoundstetrahydrofurans |
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| Substituents | monocyclic benzene moietyetherfurofuran lignan skeletontetrahydrofuran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoiddialkyl etheroxacyclefuran lignan skeletonorganic oxygen compoundaromatic heteropolycyclic compoundfurofuranphenolhydrocarbon derivativebenzenoidorganoheterocyclic compoundorganooxygen compound |
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