Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:18:05 UTC |
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Update Date | 2025-03-21 18:35:26 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00105643 |
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Frequency | 25.6 |
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Structure | |
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Chemical Formula | C11H14O6 |
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Molecular Mass | 242.079 |
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SMILES | OCC1OC(Oc2ccccc2O)C(O)C1O |
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InChI Key | AXISTBBMVBSJCY-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 | phenol ethers |
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Subclass | phenol ethers |
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Direct Parent | phenol ethers |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetalshydrocarbon derivativesmonosaccharidesoxacyclic compoundsphenoxy compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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Substituents | alcoholphenol ethermonocyclic benzene moietyaromatic heteromonocyclic compoundtetrahydrofuran1-hydroxy-2-unsubstituted benzenoidmonosaccharide1-hydroxy-4-unsubstituted benzenoidoxacyclesaccharideorganic oxygen compoundacetalsecondary alcoholphenolhydrocarbon derivativephenoxy compoundprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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