| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:47 UTC |
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| Update Date | 2025-03-25 00:53:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203006 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H16O10 |
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| Molecular Mass | 356.0743 |
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| SMILES | O=C1CC(=O)c2c(O)cc(OC3OC(CO)C(O)C(O)C3O)cc2O1 |
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| InChI Key | UKYQEWMXLVTCGA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | coumarins and derivatives |
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| Subclass | coumarin glycosides |
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| Direct Parent | coumarin glycosides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids3,4-dihydrocoumarinsacetalsaryl alkyl ketonescarboxylic acid esterschromoneshydrocarbon derivativeslactonesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesoxacyclic compoundsoxanesphenol ethersprimary alcoholssecondary alcoholsvinylogous acids |
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| Substituents | coumarin-7-o-glycosidephenol ethercarbonyl grouparyl alkyl ketonecoumarin o-glycoside1-benzopyran1-hydroxy-2-unsubstituted benzenoidmonosaccharidecarboxylic acid derivativeketonelactonesaccharideorganic oxideacetalchromonearomatic heteropolycyclic compoundchromaneoxaneprimary alcoholorganoheterocyclic compoundalcoholbenzopyran3,4-dihydrocoumarin1-hydroxy-4-unsubstituted benzenoidoxacyclevinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativebenzenoidorganooxygen compoundaryl ketone |
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