| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:55 UTC |
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| Update Date | 2025-03-25 00:56:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221988 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H20O7 |
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| Molecular Mass | 360.1209 |
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| SMILES | Oc1ccc(C2OCC3COC(c4ccc(O)c(O)c4)C3CO2)cc1O |
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| InChI Key | DBJBSZQNDHVKGI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dioxepanes |
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| Subclass | 1,3-dioxepanes |
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| Direct Parent | 1,3-dioxepanes |
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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 derivativesdialkyl ethershydrocarbon derivativesoxacyclic compoundstetrahydrofurans |
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| Substituents | 1,3-dioxepanemonocyclic benzene moietyethertetrahydrofuran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoiddialkyl etheroxacycleorganic oxygen compoundacetalaromatic heteropolycyclic compoundphenolhydrocarbon derivativebenzenoidorganooxygen compound |
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