| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:04 UTC |
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| Update Date | 2025-03-25 01:01:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02247312 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O2S2 |
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| Molecular Mass | 206.0435 |
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| SMILES | COC(=O)CCC1CCSSC1 |
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| InChI Key | ZROWEGJCNHHPTK-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 acid esters |
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| Direct Parent | fatty acid esters |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundsdithianeshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic disulfidesorganic oxides |
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| Substituents | carbonyl groupcarboxylic acid derivative1,2-dithianefatty acid esterorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundorganic disulfidecarboxylic acid esteraliphatic heteromonocyclic compoundhydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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