| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:34 UTC |
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| Update Date | 2025-03-25 00:54:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204839 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H14O6S |
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| Molecular Mass | 322.0511 |
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| SMILES | O=S(O)C1=CC2=C(CC(O)C(c3ccc(O)cc3)C(O)=C1)O2 |
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| InChI Key | SUBQSVQELNNIJI-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 | phenols |
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| Subclass | 1-hydroxy-2-unsubstituted benzenoids |
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| Direct Parent | 1-hydroxy-2-unsubstituted benzenoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | benzene and substituted derivativeshydrocarbon derivativesorganic oxidesorganosulfur compoundsoxacyclic compoundsoxirenessecondary alcoholssulfinic acids |
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| Substituents | alcoholmonocyclic benzene moietyoxirenesulfinic acid derivative1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundsulfinic acidoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundsecondary alcoholhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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