| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:28:05 UTC |
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| Update Date | 2025-03-21 18:40:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00129628 |
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| Frequency | 19.6 |
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| Structure | |
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| Chemical Formula | C7H12O2S3 |
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| Molecular Mass | 223.9999 |
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| SMILES | O=C(O)CCCCC1CSSS1 |
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| InChI Key | APNBCWDDBXDDJK-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 | medium-chain fatty acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganic trisulfidestrithiolanes |
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| Substituents | carbonyl groupcarboxylic acidtrithiolaneheterocyclic fatty acidorganic trisulfidecarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativemedium-chain fatty acidorganoheterocyclic compoundorganooxygen compound |
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