| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:00 UTC |
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| Update Date | 2025-03-21 18:36:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00110348 |
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| Frequency | 24.2 |
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| Structure | |
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| Chemical Formula | C7H11NO5S |
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| Molecular Mass | 221.0358 |
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| SMILES | O=C(O)CCCCC1C(=O)NS1(=O)=O |
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| InChI Key | KYOVSDOUDRFUPM-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 compoundsbeta sultamscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsorganosulfonic acids and derivativesthiazetidines |
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| Substituents | beta-sultamorganosulfonic acid or derivativescarbonyl group1,2-thiazetidinecarboxylic acidazacycleheterocyclic fatty acidcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativesaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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