| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:53 UTC |
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| Update Date | 2025-03-25 00:56:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221907 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H10O8S |
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| Molecular Mass | 350.0096 |
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| SMILES | O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(S(=O)(=O)O)c12 |
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| InChI Key | AGWXUGNTFQLYIC-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 | 3'-hydroxyflavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids1-sulfo,2-unsubstituted aromatic compounds4'-hydroxyflavonoids7-hydroxyflavonoidsarylsulfonic acids and derivativesbenzene and substituted derivativeschromonesflavonoidsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganosulfonic acidsoxacyclic compoundspyranones and derivativessulfonyls |
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| Substituents | organosulfonic acid or derivativesmonocyclic benzene moiety1-benzopyranorganosulfonic acid1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundorganic oxidechromonearomatic heteropolycyclic compoundpyranoneorganoheterocyclic compoundbenzopyran1-sulfo,2-unsubstituted aromatic compoundheteroaromatic compound1-hydroxy-4-unsubstituted benzenoid3'-hydroxyflavonoidoxacyclesulfonylarylsulfonic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativespyran7-hydroxyflavonoid4'-hydroxyflavonoidphenolhydrocarbon derivativebenzenoidorganooxygen compound |
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