DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:27:43 UTC
Update Date	2025-03-21 18:40:09 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00128770
Frequency	36.5
Structure
Chemical Formula	C₁₄H₂₅N₃O₇
Molecular Mass	347.1692
SMILES	CC(C)CC(NC(=O)CCC(N)C(=O)O)C(O)=NC(CO)C(=O)O
InChI Key	XGGONOBOZIOZOA-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	glutamine and derivatives
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	alpha amino acids beta hydroxy acids and derivatives branched fatty acids carbonyl compounds carboximidic acids carboxylic acids dicarboxylic acids and derivatives hydrocarbon derivatives hydroxy fatty acids monoalkylamines n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds primary alcohols propargyl-type 1,3-dipolar organic compounds secondary carboxylic acid amides serine and derivatives short-chain hydroxy acids and derivatives
Substituents	fatty acyl aliphatic acyclic compound carboximidic acid carbonyl group carboxylic acid short-chain hydroxy acid glutamine or derivatives fatty amide fatty acid propargyl-type 1,3-dipolar organic compound beta-hydroxy acid organic oxide organonitrogen compound alpha-amino acid organopnictogen compound hydroxy fatty acid primary alcohol alcohol organic 1,3-dipolar compound hydroxy acid carboxamide group branched fatty acid n-acyl-amine secondary carboxylic acid amide organic oxygen compound dicarboxylic acid or derivatives hydrocarbon derivative primary aliphatic amine organic nitrogen compound serine or derivatives organooxygen compound

Showing information for DMID00128770