| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:12 UTC |
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| Update Date | 2025-03-25 00:57:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222660 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H10O6S |
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| Molecular Mass | 306.0198 |
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| SMILES | O=S(=O)(O)Oc1cc(O)c2ccc3cc(O)ccc3c2c1 |
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| InChI Key | CCHXPRSAGBZNPL-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 | phenanthrenes and derivatives |
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| Subclass | phenanthrols |
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| Direct Parent | phenanthrols |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsarylsulfateshydrocarbon derivativesnaphthols and derivativesorganic oxidesorganooxygen compoundssulfuric acid monoesters |
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| Substituents | sulfuric acid monoesterorganic sulfuric acid or derivativesphenanthrol1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compound1-hydroxy-4-unsubstituted benzenoidorganic oxidenaphthaleneorganic oxygen compoundsulfate-esterhydrocarbon derivative1-naphtholarylsulfatesulfuric acid ester2-naphtholorganooxygen compound |
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