DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:12:01 UTC
Update Date	2025-03-25 00:58:08 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02228833
Frequency	0.5
Structure
Chemical Formula	C₁₅H₂₃N₃O₆
Molecular Mass	341.1587
SMILES	CC(=O)NC(CCN1CCC1C(=O)O)C(=O)N1CCCC1C(=O)O
InChI Key	CCKOKMKJICHCKA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	carboxylic acids and derivatives
Subclass	amino acids, peptides, and analogues
Direct Parent	dipeptides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	acetamides alpha amino acid amides alpha amino acids amino acids azacyclic compounds azetidinecarboxylic acids azetidines carbonyl compounds carboxylic acids dicarboxylic acids and derivatives hydrocarbon derivatives n-acyl-alpha amino acids n-acylpyrrolidines organic oxides organopnictogen compounds proline and derivatives pyrrolidine carboxylic acids secondary carboxylic acid amides tertiary carboxylic acid amides trialkylamines
Substituents	carbonyl group carboxylic acid amino acid or derivatives amino acid n-acylpyrrolidine azetidinecarboxylic acid alpha-amino acid or derivatives organic oxide pyrrolidine carboxylic acid tertiary carboxylic acid amide aliphatic heteromonocyclic compound alpha-amino acid organonitrogen compound organopnictogen compound pyrrolidine tertiary amine organoheterocyclic compound acetamide n-acyl-alpha amino acid or derivatives proline or derivatives alpha-amino acid amide azacycle n-acyl-alpha-amino acid tertiary aliphatic amine carboxamide group azetidine alpha-dipeptide secondary carboxylic acid amide pyrrolidine carboxylic acid or derivatives organic oxygen compound dicarboxylic acid or derivatives hydrocarbon derivative organic nitrogen compound amine organooxygen compound

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