| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:46 UTC |
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| Update Date | 2025-03-21 18:02:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038023 |
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| Frequency | 92.2 |
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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(c2ccc(O)cc2O)C(O)C(O)C1O |
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| InChI Key | PDXPEMLNNWECAR-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 benzenoidsbenzene and substituted derivativesdialkyl ethershydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanesprimary alcoholssecondary alcohols |
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| Substituents | alcoholmonocyclic benzene moietyetheraromatic heteromonocyclic compound1-hydroxy-2-unsubstituted benzenoidmonosaccharide1-hydroxy-4-unsubstituted benzenoiddialkyl etherresorcinoloxacyclesaccharideorganic oxygen compoundsecondary alcoholhydrocarbon derivativeoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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