| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:03 UTC |
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| Update Date | 2025-03-25 00:57:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02226733 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H17NO3S |
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| Molecular Mass | 219.0929 |
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| SMILES | CC(O)CCC=CCC(O)=NS(C)=O |
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| InChI Key | NWBDEZXAJVDZPW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | sulfinic acids and derivatives |
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| Subclass | sulfinic acids and derivatives |
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| Direct Parent | sulfinic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | hydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcoholssulfinyl compounds |
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| Substituents | alcoholaliphatic acyclic compoundsulfinic acid derivativeorganosulfur compoundorganic oxideorganic oxygen compoundsulfinyl compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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