| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:10 UTC |
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| Update Date | 2025-03-25 00:57:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222551 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H6O2S |
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| Molecular Mass | 166.0088 |
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| SMILES | O=C1SCc2ccc(O)cc21 |
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| InChI Key | JBTOBEBLQJCZGK-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 | benzenoidscarbothioic s-lactonescarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsthioestersthiolactones |
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| Substituents | carbothioic s-lactonethiocarboxylic acid or derivativesthiocarboxylic acid ester1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativethiolactoneorganoheterocyclic compoundorganooxygen compound |
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