| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:33 UTC |
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| Update Date | 2025-03-25 00:59:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234579 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H10O6S |
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| Molecular Mass | 318.0198 |
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| SMILES | O=c1cc(-c2ccc(O)cc2)oc2cc(S(=O)(=O)O)ccc12 |
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| InChI Key | CHLOSBFLEUPCCA-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 | 4'-hydroxyflavonoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-sulfo,2-unsubstituted aromatic compoundsarylsulfonic 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 compoundoxacyclesulfonylarylsulfonic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativespyran4'-hydroxyflavonoidphenolhydrocarbon derivativebenzenoidorganooxygen compound |
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