| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:44:22 UTC |
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| Update Date | 2025-03-21 18:00:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00025174 |
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| Frequency | 153.7 |
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| Structure | |
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| Chemical Formula | C11H18O2S |
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| Molecular Mass | 214.1028 |
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| SMILES | CSC=C(C)CC1(O)C=CC(O)CC1 |
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| InChI Key | SICQZXNTXZHCCA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | tertiary alcohols |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativessecondary alcoholssulfenyl compoundsthioenol ethers |
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| Substituents | tertiary alcoholthioenolethersulfenyl compoundsecondary alcoholaliphatic homomonocyclic compoundhydrocarbon derivativeorganosulfur compound |
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