| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:08 UTC |
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| Update Date | 2025-03-25 00:59:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02238139 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H20O4S |
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| Molecular Mass | 248.1082 |
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| SMILES | O=C(O)CCCCCCCCC(O)C(=O)S |
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| InChI Key | FYYVGOSBJVKOTB-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 | hydroxy acids and derivatives |
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| Subclass | medium-chain hydroxy acids and derivatives |
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| Direct Parent | medium-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkylthiolscarbodithioic acidscarbonyl compoundscarbothioic s-acidscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganosulfur compoundssecondary alcoholsthiocarboxylic acids and derivativesthiolactones |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidmonosaccharidefatty acidorganosulfur compoundcarboxylic acid derivativemedium-chain hydroxy acidsaccharideorganic oxidemedium-chain fatty acidhydroxy fatty acidthiolactonealcoholthiocarboxylic acid or derivativescarbodithioic acidcarbothioic s-acidmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativealkylthiolorganooxygen compound |
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