| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:10:20 UTC |
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| Update Date | 2025-03-21 18:31:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00086877 |
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| Frequency | 32.8 |
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| Structure | |
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| Chemical Formula | C7H12OS2 |
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| Molecular Mass | 176.033 |
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| SMILES | O=CCCCC1CCSS1 |
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| InChI Key | PPKWCHHPEHGWNS-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | dithiolanes |
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| Subclass | 1,2-dithiolanes |
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| Direct Parent | 1,2-dithiolanes |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha-hydrogen aldehydeshydrocarbon derivativesorganic disulfidesorganic oxides |
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| Substituents | carbonyl groupaldehyde1,2-dithiolaneorganic oxideorganic oxygen compoundalpha-hydrogen aldehydeorganic disulfidealiphatic heteromonocyclic compoundhydrocarbon derivativeorganooxygen compound |
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