| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:05 UTC |
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| Update Date | 2025-03-25 00:47:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160361 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H15NO7S |
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| Molecular Mass | 353.0569 |
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| SMILES | NS(=O)(=O)OC1Cc2cc(O)ccc2OC1c1ccc(O)c(O)c1 |
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| InChI Key | CCYIJRJJWOMPSV-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 | flavonoids |
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| Subclass | hydroxyflavonoids |
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| Direct Parent | 6-hydroxyflavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyrans1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids3'-hydroxyflavonoids4'-hydroxyflavonoidsalkyl aryl ethersbenzene and substituted derivativesflavan-3-olshydrocarbon derivativesorganic nitrogen compoundsorganic oxidesorganic sulfuric acids and derivativesoxacyclic compounds |
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| Substituents | monocyclic benzene moietyether1-benzopyranflavan1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherorganic oxidearomatic heteropolycyclic compoundchromaneflavan-3-olorganoheterocyclic compoundbenzopyranorganic sulfuric acid or derivatives6-hydroxyflavonoid1-hydroxy-4-unsubstituted benzenoid3'-hydroxyflavonoidoxacycleorganic oxygen compound4'-hydroxyflavonoidphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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