| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:38 UTC |
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| Update Date | 2025-03-25 00:51:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189075 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20N2O5 |
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| Molecular Mass | 272.1372 |
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| SMILES | CC(C)CC(NC(=O)CN1CCC1C(=O)O)C(=O)O |
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| InChI Key | RFZVWTBHCMPBGJ-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 heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsamino acidsazacyclic compoundsazetidinecarboxylic acidsazetidinescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheterocyclic fatty acidshydrocarbon derivativesleucine and derivativesmethyl-branched fatty acidsn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestrialkylamines |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidamino acid or derivativesamino acidheterocyclic fatty acidfatty acidazetidinecarboxylic acidalpha-amino acid or derivativesorganic oxideleucine or derivativesaliphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesmethyl-branched fatty acidalpha-amino acid amideazacyclen-acyl-alpha-amino acidtertiary aliphatic aminecarboxamide groupbranched fatty acidazetidinealpha-dipeptidesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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