| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:50 UTC |
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| Update Date | 2025-03-21 18:03:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00042935 |
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| Frequency | 79.4 |
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| Structure | |
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| Chemical Formula | C6H12O2S |
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| Molecular Mass | 148.0558 |
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| SMILES | CSCCC(C)C(=O)O |
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| InChI Key | QSCMVGTXPXZIOH-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | thia fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdialkylthioethershydrocarbon derivativesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidessulfenyl compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidmethyl-branched fatty acidsulfenyl compounddialkylthioetherorganosulfur compoundcarboxylic acid derivativebranched fatty acidorganic oxidemonocarboxylic acid or derivativesthia fatty acidorganic oxygen compoundthioetherhydrocarbon derivativeorganooxygen compound |
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