| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:50 UTC |
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| Update Date | 2025-03-25 00:46:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157616 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14N2O5S |
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| Molecular Mass | 274.0623 |
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| SMILES | O=C(O)CCC1C(C(=O)O)CSC2NC(=O)NC21 |
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| InChI Key | SCYHGPBWSKNMBG-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 | thianes |
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| Subclass | thianes |
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| Direct Parent | thianes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdialkylthioethersdicarboxylic acids and derivativeshydrocarbon derivativesimidazolidinonesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsthiohemiaminal derivatives |
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| Substituents | imidazolidinecarbonyl groupcarbonic acid derivativecarboxylic acidazacycledialkylthioethercarboxylic acid derivativealiphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganic oxygen compoundthioetherorganonitrogen compoundhemithioaminaldicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundthiane |
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