| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:12 UTC |
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| Update Date | 2025-03-25 01:00:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245272 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H18N2O5 |
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| Molecular Mass | 270.1216 |
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| SMILES | CN1C(C(=O)O)CCC1C(=O)N1CCCC1C(=O)O |
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| InChI Key | NNRWHSPPAVPJNA-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 compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesn-acyl-alpha amino acidsn-acylpyrrolidinesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundsproline and derivativespyrrolidine carboxylic acidspyrrolidinecarboxamidestertiary carboxylic acid amidestrialkylamines |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidn-acylpyrrolidinealpha-amino acid or derivativesorganic oxidepyrrolidine carboxylic acidtertiary carboxylic acid amidealiphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundpyrrolidinetertiary amineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesproline or derivativesalpha-amino acid amideazacyclen-acyl-alpha-amino acidn-alkylpyrrolidinetertiary aliphatic aminecarboxamide groupalpha-dipeptidepyrrolidine carboxylic acid or derivativesorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundpyrrolidine-2-carboxamideamineorganooxygen compound |
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