| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:39 UTC |
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| Update Date | 2025-03-25 00:59:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234800 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H12O5S |
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| Molecular Mass | 292.0405 |
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| SMILES | O=S(O)c1cc(O)cc2c1-c1c(O)cc(O)cc1CC2 |
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| InChI Key | YYMQAXDUAPGEST-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 | phenanthrenes and derivatives |
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| Direct Parent | phenanthrenes and derivatives |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidshydrocarbon derivativesnaphthalenesorganic oxidesorganooxygen compoundsorganosulfur compoundssulfinic acids |
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| Substituents | phenanthrenesulfinic acid derivative1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compound1-hydroxy-4-unsubstituted benzenoidorganosulfur compoundsulfinic acidorganic oxidenaphthaleneorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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