| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:34 UTC |
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| Update Date | 2025-03-21 18:05:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00058768 |
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| Frequency | 53.7 |
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| Structure | |
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| Chemical Formula | C7H12N2O5S |
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| Molecular Mass | 236.0467 |
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| SMILES | O=C(O)CCCCC1NC(=O)NS1(=O)=O |
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| InChI Key | PQPCTVGYOHTHKT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | medium-chain fatty acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsorganosulfonic acids and derivativessulfonylureasthiadiazolidines |
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| Substituents | organosulfonic acid or derivativescarbonyl groupcarbonic acid derivativecarboxylic acidthiadiazolidineazacycleheterocyclic fatty acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativessulfonylureaaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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