DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:21:19 UTC
Update Date	2025-03-25 01:01:33 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02250117
Frequency	0.5
Structure
Chemical Formula	C₁₁H₂₁N₃O₃S
Molecular Mass	275.1304
SMILES	CSCCC(N)C(=O)NC(CCC(N)=O)C(C)=O
InChI Key	UTWJMRUDTWTLKB-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	alpha amino acid amides alpha amino acids carboxylic acids and derivatives dialkylthioethers gamma amino acids and derivatives hydrocarbon derivatives ketones methionine and derivatives monoalkylamines n-acyl amines organic oxides organonitrogen compounds organopnictogen compounds primary carboxylic acid amides secondary carboxylic acid amides sulfenyl compounds
Substituents	primary carboxylic acid amide fatty acyl aliphatic acyclic compound carbonyl group gamma amino acid or derivatives fatty amide alpha-amino acid or derivatives organosulfur compound carboxylic acid derivative ketone organic oxide organonitrogen compound alpha-amino acid organopnictogen compound sulfenyl compound alpha-amino acid amide dialkylthioether carboxamide group n-acyl-amine secondary carboxylic acid amide organic oxygen compound thioether methionine or derivatives hybrid peptide hydrocarbon derivative primary aliphatic amine organic nitrogen compound organooxygen compound

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