Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:51:57 UTC |
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Update Date | 2025-03-25 00:50:46 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02182964 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C11H8O6S |
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Molecular Mass | 268.0042 |
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SMILES | O=c1cc(OS(=O)(=O)O)ccc2cccc(O)c12 |
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InChI Key | YHXHDLHNNGCVEP-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 homopolycyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzenoidsorganic oxidesorganooxygen compoundssulfuric acid monoesterstroponesvinylogous acids |
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Substituents | sulfuric acid monoestertropone1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compound1-hydroxy-4-unsubstituted benzenoidvinylogous acidorganic oxideorganic oxygen compoundsulfate-esterhydrocarbon derivativearylsulfatebenzenoidsulfuric acid esterorganooxygen compound |
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