| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:08 UTC |
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| Update Date | 2025-03-21 18:02:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041228 |
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| Frequency | 83.5 |
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| Structure | |
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| Chemical Formula | C12H16O8 |
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| Molecular Mass | 288.0845 |
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| SMILES | OCC1OC(c2cc(O)c(O)c(O)c2)C(O)C(O)C1O |
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| InChI Key | WWHFLAFCTONTMD-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 | benzenetriols and derivatives |
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| Direct Parent | pyrogallols and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativesdialkyl ethershydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholmonocyclic benzene moietyetherpyrogallol derivativearomatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmonosaccharide1-hydroxy-4-unsubstituted benzenoiddialkyl etheroxacyclesaccharideorganic oxygen compoundsecondary alcoholhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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