| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:10:48 UTC |
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| Update Date | 2025-03-21 18:31:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00087924 |
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| Frequency | 32.3 |
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| Structure | |
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| Chemical Formula | C4H8O5S |
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| Molecular Mass | 168.0092 |
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| SMILES | O=C(O)C(O)CCS(=O)O |
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| InChI Key | WQXXUHBOSHKPIA-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 | hydroxy fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkanesulfinic acids and derivativesalpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganosulfur compoundssecondary alcoholsshort-chain hydroxy acids and derivativessulfinic acidsthia fatty acids |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidsulfinic acid derivativealpha-hydroxy acidmonosaccharideorganosulfur compoundcarboxylic acid derivativesulfinic acidalkanesulfinic acid or derivativessaccharideorganic oxidehydroxy fatty acidalcoholhydroxy acidmonocarboxylic acid or derivativesthia fatty acidorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
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