DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 00:27:36 UTC
Update Date	2025-03-21 18:40:05 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID00128502
Frequency	25.3
Structure
Chemical Formula	C₉H₁₆N₂O₅
Molecular Mass	232.1059
SMILES	O=C(O)CCCNCCC(=O)NCC(=O)O
InChI Key	NKYFYEGDNYQCKL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	organic acids and derivatives
Class	peptidomimetics
Subclass	hybrid peptides
Direct Parent	hybrid peptides
Geometric Descriptor	aliphatic acyclic compounds
Alternative Parents	acyl glycines alpha amino acids amino acids beta amino acids and derivatives carbonyl compounds carboxylic acids dialkylamines dicarboxylic acids and derivatives fatty acids and conjugates gamma amino acids and derivatives hydrocarbon derivatives organic oxides organopnictogen compounds secondary carboxylic acid amides
Substituents	aliphatic acyclic compound carbonyl group carboxylic acid amino acid or derivatives amino acid gamma amino acid or derivatives fatty acid alpha-amino acid or derivatives carboxylic acid derivative organic oxide organonitrogen compound alpha-amino acid organopnictogen compound n-acyl-alpha amino acid or derivatives secondary aliphatic amine n-acyl-alpha-amino acid secondary amine carboxamide group beta amino acid or derivatives n-acylglycine secondary carboxylic acid amide organic oxygen compound dicarboxylic acid or derivatives hybrid peptide hydrocarbon derivative organic nitrogen compound organooxygen compound amine

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