| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:28 UTC |
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| Update Date | 2025-03-25 00:49:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02177329 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H16O2S |
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| Molecular Mass | 224.0871 |
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| SMILES | Cc1ccc2c(c1)S(=O)(=O)CCC2(C)C |
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| InChI Key | OSMVVPLDODTRLU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | thiochromanes |
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| Subclass | thiochromanes |
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| Direct Parent | thiochromanes |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzothiopyransbenzenoidshydrocarbon derivativesorganic oxidessulfonesthiopyrans |
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| Substituents | thiochromaneorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundbenzothiopyranhydrocarbon derivativebenzenoidthiopyransulfone1-benzothiopyran |
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