| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:42 UTC |
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| Update Date | 2025-03-25 00:47:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159549 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H4O5S2 |
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| Molecular Mass | 207.95 |
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| SMILES | O=Cc1ccc(OS(=O)(=O)O)s1 |
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| InChI Key | CIWOVJXXRFWWMD-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 | arylsulfates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2,5-disubstituted thiophenesaryl-aldehydesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundssulfuric acid monoestersthiophene carboxylic acids and derivatives |
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| Substituents | 2,5-disubstituted thiophenesulfuric acid monoesteraromatic heteromonocyclic compoundheteroaromatic compoundaldehydethiophenethiophene carboxylic acid or derivativesorganic oxidearyl-aldehydeorganic oxygen compoundsulfate-esterhydrocarbon derivativearylsulfatesulfuric acid esterorganoheterocyclic compoundorganooxygen compound |
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