| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:50 UTC |
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| Update Date | 2025-03-21 18:32:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00090356 |
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| Frequency | 31.2 |
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| Structure | |
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| Chemical Formula | C8H12O2S2 |
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| Molecular Mass | 204.0279 |
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| SMILES | O=C(O)CCCCC1C=CSS1 |
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| InChI Key | PMIMBLOPIYIRPI-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 | 1,2-dithiolescarbonyl compoundscarboxylic acidsfatty acylsheterocyclic fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic disulfidesorganic oxides |
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| Substituents | 1,2-dithiolecarbonyl groupcarboxylic acidheterocyclic fatty acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganic disulfidealiphatic heteromonocyclic compounddithiolehydrocarbon derivativemedium-chain fatty acidorganoheterocyclic compoundorganooxygen compound |
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