| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:53:48 UTC |
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| Update Date | 2025-03-21 18:03:59 UTC |
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| HMDB ID | HMDB0244180 |
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| Metabolite Identification |
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| DeepMet ID | DMID00047705 |
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| Name | 1,3-Propane sultone |
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| Frequency | 69.7 |
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| Structure | |
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| Chemical Formula | C3H6O3S |
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| Molecular Mass | 122.0038 |
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| SMILES | O=S1(=O)CCCO1 |
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| InChI Key | FSSPGSAQUIYDCN-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 | oxathiolanes |
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| Subclass | gamma sultones |
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| Direct Parent | gamma sultones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidesorganooxygen compoundsorganosulfonic acid estersoxacyclic compoundssulfonic acid esters |
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| Substituents | organosulfonic acid or derivativesorganosulfonic acid estersulfonic acid esteroxacycleorganic oxideorganic oxygen compoundorganic sulfonic acid or derivativesaliphatic heteromonocyclic compoundhydrocarbon derivativegamma-sultoneorganooxygen compound |
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