| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:13:57 UTC |
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| Update Date | 2025-03-25 00:58:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02233175 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H20N2O5 |
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| Molecular Mass | 260.1372 |
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| SMILES | CCC(C)C(NC(=O)C(C(=O)O)N(C)C)C(=O)O |
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| InChI Key | SMOXWLMBPXTUHP-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 | dipeptides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,3-dicarbonyl compoundsalpha amino acid amidesalpha amino acidsamino acidscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesisoleucine and derivativesmethyl-branched fatty acidsn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestrialkylamines |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acid or derivativesamino acidfatty acidalpha-amino acid or derivativesorganic oxidealpha-amino acidorganonitrogen compoundorganopnictogen compoundisoleucine or derivativestertiary aminen-acyl-alpha amino acid or derivativesmethyl-branched fatty acidalpha-amino acid amiden-acyl-alpha-amino acidtertiary aliphatic aminecarboxamide groupbranched fatty acidalpha-dipeptidesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compound1,3-dicarbonyl compoundamineorganooxygen compound |
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