Record Information |
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HMDB Status | expected |
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Creation Date | 2024-02-20 23:35:48 UTC |
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Update Date | 2025-03-21 17:57:06 UTC |
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HMDB ID | HMDB0240565 |
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Metabolite Identification |
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DeepMet ID | DMID00005678 |
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Name | Umbelliferone sulfate |
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Frequency | 932.0 |
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Structure | |
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Chemical Formula | C9H6O6S |
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Molecular Mass | 241.9885 |
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SMILES | O=c1ccc2ccc(OS(=O)(=O)O)cc2o1 |
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InChI Key | LJOOSFYJELZGMR-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 | coumarins and derivatives |
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Subclass | coumarins and derivatives |
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Direct Parent | coumarins and derivatives |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-benzopyransarylsulfatesbenzenoidsheteroaromatic compoundshydrocarbon derivativeslactonesorganic oxidesorganooxygen compoundsoxacyclic compoundspyranones and derivativessulfuric acid monoesters |
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Substituents | sulfuric acid monoesterbenzopyranorganic sulfuric acid or derivatives1-benzopyranheteroaromatic compoundcoumarinlactoneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundpyranpyranonesulfate-esterhydrocarbon derivativearylsulfatebenzenoidsulfuric acid esterorganoheterocyclic compoundorganooxygen compound |
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