| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:20 UTC |
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| Update Date | 2025-03-25 00:52:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02192873 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H23NO4 |
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| Molecular Mass | 245.1627 |
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| SMILES | CCCCC(O)=NC(O)CCCCCC(=O)O |
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| InChI Key | TYMAMGJKXQFPOY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | medium-chain hydroxy acids and derivatives |
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| Direct Parent | medium-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkanolaminesamino fatty acidscarbonyl compoundscarboximidic acidscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundsstraight chain fatty acids |
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| Substituents | fatty acylaliphatic acyclic compoundcarboximidic acidcarbonyl groupstraight chain fatty acidcarboxylic acidfatty acidorganic 1,3-dipolar compoundcarboxylic acid derivativeamino fatty acidmedium-chain hydroxy acidpropargyl-type 1,3-dipolar organic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativemedium-chain fatty acidhydroxy fatty acidorganic nitrogen compoundorganooxygen compoundalkanolamine |
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