| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:07 UTC |
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| Update Date | 2025-03-25 00:49:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176487 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H18N2O7S |
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| Molecular Mass | 334.0835 |
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| SMILES | O=C(O)CCCCC1C(C(=O)O)C2NC(=O)NC2CS1(=O)=O |
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| InChI Key | SCSYLCKAFXJNDY-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 heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheterocyclic fatty acidshydrocarbon derivativesimidazolidinonesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfonesthianes |
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| Substituents | imidazolidinecarbonyl groupcarbonic acid derivativecarboxylic acidazacycleheterocyclic fatty acidcarboxylic acid derivativealiphatic heteropolycyclic compoundimidazolidinoneorganic oxideorganic oxygen compoundorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundsulfonethiane |
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