| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:42:12 UTC |
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| Update Date | 2025-03-21 17:59:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00020207 |
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| Frequency | 200.9 |
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| Structure | |
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| Chemical Formula | C12H16O9 |
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| Molecular Mass | 304.0794 |
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| SMILES | Oc1cccc(O)c1OC1OC(C(O)O)C(O)C(O)C1O |
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| InChI Key | CCZWRQTWSFWYFX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | benzenediols |
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| Direct Parent | resorcinols |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalscarbonyl hydrateshydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanesphenol ethersphenoxy compoundssecondary alcohols |
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| Substituents | alcoholphenol ethermonocyclic benzene moietycarbonyl hydratearomatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmonosaccharide1-hydroxy-4-unsubstituted benzenoidresorcinoloxacyclesaccharideorganic oxygen compoundacetalsecondary alcoholhydrocarbon derivativephenoxy compoundoxaneorganoheterocyclic compoundorganooxygen compound |
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