| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:06 UTC |
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| Update Date | 2025-03-25 00:59:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235838 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H8O6S |
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| Molecular Mass | 244.0042 |
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| SMILES | COc1cc2c(S(=O)(=O)O)coc2cc1O |
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| InChI Key | JGYYXOGRSQXAQH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | benzofurans |
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| Subclass | benzofurans |
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| Direct Parent | benzofurans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesarylsulfonic acids and derivativesfuransheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganosulfonic acidsoxacyclic compoundssulfonyls |
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| Substituents | furanphenol etherorganosulfonic acid or derivativesetherbenzofuranheteroaromatic compoundorganosulfonic acid1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherorganosulfur compoundoxacycleorganic oxidesulfonylorganic oxygen compoundarylsulfonic acid or derivativesaromatic heteropolycyclic compoundorganic sulfonic acid or derivativesanisolehydrocarbon derivativebenzenoidorganooxygen compound |
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