| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:35 UTC |
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| Update Date | 2025-03-21 18:02:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037586 |
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| Frequency | 93.6 |
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| Structure | |
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| Chemical Formula | C11H10O4S |
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| Molecular Mass | 238.03 |
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| SMILES | Cc1cccc2ccc(OS(=O)(=O)O)cc12 |
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| InChI Key | FXQQYMMDWSOVBT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | naphthalenes |
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| Subclass | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | arylsulfateshydrocarbon derivativesorganic oxidesorganooxygen compoundssulfuric acid monoesters |
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| Substituents | sulfuric acid monoesterorganic sulfuric acid or derivativesaromatic homopolycyclic compoundorganic oxidenaphthaleneorganic oxygen compoundsulfate-esterhydrocarbon derivativearylsulfatesulfuric acid esterorganooxygen compound |
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