| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:39:34 UTC |
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| Update Date | 2025-03-21 17:58:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00014439 |
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| Frequency | 305.4 |
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| Structure | |
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| Chemical Formula | C12H20N2O5S |
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| Molecular Mass | 304.1093 |
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| SMILES | O=C(O)CCCCCCC1C2NC(=O)NC2CS1(=O)=O |
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| InChI Key | CNBPMOZRGMJJFO-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 | thienoimidazolidines |
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| Subclass | thienoimidazolidines |
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| Direct Parent | thienoimidazolidines |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesimidazolidinonesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfonesthiolanesthiophenes |
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| Substituents | thiolaneimidazolidinefatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidfatty acidthiophenecarboxylic acid derivativealiphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidcarbonic acid derivativeazacyclethienoimidazolidinemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundsulfone |
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