| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:21 UTC |
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| Update Date | 2025-03-25 00:47:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158773 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H20O6S |
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| Molecular Mass | 412.0981 |
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| SMILES | Oc1ccc(Sc2c(O)cc(O)c3c2CC(O)C(c2ccc(O)c(O)c2)C3)cc1 |
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| InChI Key | NHIDNWRWMXSEHI-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 | phenylnaphthalenes |
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| Direct Parent | phenylnaphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsbenzene and substituted derivativesdiarylthioethershydrocarbon derivativessecondary alcoholssulfenyl compoundstetralinsthiophenol ethersthiophenols |
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| Substituents | alcoholtetralinmonocyclic benzene moietysulfenyl compound1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compound1-hydroxy-4-unsubstituted benzenoidorganosulfur compoundaryl thioetherthiophenolorganic oxygen compoundthioetherphenylnaphthalenethiophenol ethersecondary alcoholphenolhydrocarbon derivativeorganooxygen compounddiarylthioether |
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