| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:19:08 UTC |
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| Update Date | 2025-03-21 18:35:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00108252 |
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| Frequency | 24.8 |
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| Structure | |
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| Chemical Formula | C10H16N2O3 |
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| Molecular Mass | 212.1161 |
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| SMILES | CC(C)C(NC(=O)C1CCC=N1)C(=O)O |
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| InChI Key | NIUYEXKLMSCRSU-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 | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | n-acyl-alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativesiminesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrroline carboxylic acids and derivativessecondary carboxylic acid amidesvaline and derivatives |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidheterocyclic fatty acidiminefatty acidpropargyl-type 1,3-dipolar organic compoundorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundmethyl-branched fatty acidazacyclen-acyl-alpha-amino acidpyrroline carboxylic acid or derivativesvaline or derivativesorganic 1,3-dipolar compoundcarboxamide groupbranched fatty acidsecondary carboxylic acid amidemonocarboxylic acid or derivativespyrrolineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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