| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-21 15:17:20 UTC |
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| Update Date | 2025-03-25 01:00:03 UTC |
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| HMDB ID | HMDB0039781 |
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| Metabolite Identification |
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| DeepMet ID | DMID02240869 |
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| Name | xi-2-Mercapto-3-methyl-1-butanol |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H12OS |
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| Molecular Mass | 120.0609 |
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| SMILES | CC(C)C(S)CO |
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| InChI Key | QBYYSQQYPUMFOX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | thiols |
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| Subclass | alkylthiols |
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| Direct Parent | alkylthiols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganosulfur compoundsprimary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundorganic oxygen compoundhydrocarbon derivativeprimary alcoholalkylthiolorganooxygen compound |
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