| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:54 UTC |
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| Update Date | 2025-03-25 00:47:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164486 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14O7S |
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| Molecular Mass | 278.046 |
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| SMILES | CC(O)(CO)Cc1ccc(O)c(OS(=O)(=O)O)c1 |
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| InChI Key | FSEZLAAEDCJXEU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic sulfuric acids and derivatives |
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| Subclass | arylsulfates |
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| Direct Parent | phenylsulfates |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,2-diols1-hydroxy-2-unsubstituted benzenoidshydrocarbon derivativesorganic oxidesphenoxy compoundsphenylpropanessulfuric acid monoesterstertiary alcohols |
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| Substituents | alcoholmonocyclic benzene moietysulfuric acid monoester1-hydroxy-2-unsubstituted benzenoidphenylpropanearomatic homomonocyclic compoundphenylsulfatetertiary alcoholorganic oxideorganic oxygen compoundsulfate-esterphenolhydrocarbon derivativebenzenoidphenoxy compoundsulfuric acid esterorganooxygen compound1,2-diol |
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