| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:09 UTC |
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| Update Date | 2025-03-25 00:56:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02217882 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H18O3S |
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| Molecular Mass | 218.0977 |
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| SMILES | CCCCCCC(=O)CC(S)C(=O)O |
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| InChI Key | VMGAQQBKLQZCKD-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 | keto acids and derivatives |
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| Subclass | medium-chain keto acids and derivatives |
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| Direct Parent | medium-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkylthiolscarboxylic acidsfatty acylsgamma-keto acids and derivativeshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesorganosulfur compoundsthia fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidorganosulfur compoundcarboxylic acid derivativegamma-keto acidketoneorganic oxidemonocarboxylic acid or derivativesthia fatty acidorganic oxygen compoundhydrocarbon derivativealkylthiolorganooxygen compoundmedium-chain keto acid |
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