| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:11 UTC |
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| Update Date | 2025-03-25 00:52:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02192508 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H32O5S2 |
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| Molecular Mass | 368.1691 |
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| SMILES | CCCCCCCCCCCC=CC(O)C(O)CSS(=O)(=O)O |
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| InChI Key | BTHABYMEXYUBBZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic thiosulfuric acids and derivatives |
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| Subclass | s-alkyl thiosulfates |
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| Direct Parent | s-alkyl thiosulfates |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-diolshydrocarbon derivativesorganic oxidessecondary alcoholssulfenyl compounds |
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| Substituents | alcoholaliphatic acyclic compoundorganic oxideorganic oxygen compoundsulfenyl compoundsecondary alcoholhydrocarbon derivativeorganosulfur compoundorganooxygen compound1,2-diols-alkyl thiosulfate |
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