| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:21 UTC |
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| Update Date | 2025-03-21 18:37:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00113624 |
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| Frequency | 23.3 |
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| Structure | |
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| Chemical Formula | C12H16O7 |
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| Molecular Mass | 272.0896 |
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| SMILES | OCC1OC(O)C(O)C(O)C1Oc1ccccc1O |
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| InChI Key | AOXORWLHFAGCGQ-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 benzenoidsalkyl aryl ethershemiacetalshydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanesphenoxy compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholphenol ethermonocyclic benzene moietyetheraromatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmonosaccharide1-hydroxy-4-unsubstituted benzenoidalkyl aryl etheroxacyclesaccharideorganic oxygen compoundsecondary alcoholphenolhemiacetalhydrocarbon derivativephenoxy compoundoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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