| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:38 UTC |
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| Update Date | 2025-03-25 00:47:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159414 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8O6S |
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| Molecular Mass | 232.0042 |
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| SMILES | O=S(=O)(O)OC1(O)OCc2ccccc21 |
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| InChI Key | QGUANOHNABBIDD-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 | isocoumarans |
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| Subclass | isocoumarans |
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| Direct Parent | isocoumarans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkyl sulfatesbenzenoidshydrocarbon derivativesorganic oxidesorganooxygen compoundsorthocarboxylic acid derivativesoxacyclic compoundssulfuric acid monoesters |
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| Substituents | sulfuric acid monoesterorganic sulfuric acid or derivativesoxacycleorganic oxideisocoumaranorganic oxygen compoundaromatic heteropolycyclic compoundalkyl sulfatesulfate-esterhydrocarbon derivativebenzenoidorthocarboxylic acid derivativesulfuric acid esterorganooxygen compound |
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