| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:48 UTC |
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| Update Date | 2025-03-25 01:01:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251262 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H18O7 |
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| Molecular Mass | 286.1053 |
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| SMILES | OC(O)C1OC(O)C(O)C(O)C1OCc1ccccc1 |
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| InChI Key | KKTYJSXATRSJLU-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 | benzene and substituted derivatives |
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| Subclass | benzylethers |
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| Direct Parent | benzylethers |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,1-diols1,2-diolscarbonyl hydratesdialkyl ethershemiacetalshydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanessecondary alcohols |
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| Substituents | alcoholetherbenzylethercarbonyl hydratearomatic heteromonocyclic compoundmonosaccharide1,1-dioldialkyl etheroxacyclesaccharideorganic oxygen compoundsecondary alcoholhemiacetalhydrocarbon derivativeoxaneorganoheterocyclic compoundorganooxygen compound1,2-diol |
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