| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:42 UTC |
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| Update Date | 2025-03-25 00:58:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02232623 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H16OS |
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| Molecular Mass | 172.0922 |
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| SMILES | CCC=C=CCCCS(C)=O |
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| InChI Key | NQLSMCHCVVXXMC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organosulfur compounds |
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| Class | sulfoxides |
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| Subclass | sulfoxides |
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| Direct Parent | sulfoxides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidessulfinyl compounds |
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| Substituents | aliphatic acyclic compoundorganic oxideorganic oxygen compoundsulfinyl compoundsulfoxidehydrocarbon derivative |
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