DeepMet

Record Information
HMDB Status	expected
Creation Date	2024-02-20 23:34:35 UTC
Update Date	2025-03-21 17:56:40 UTC
HMDB ID	HMDB0029023
Metabolite Identification
DeepMet ID	DMID00002848
Name	Prolyl-Methionine
Frequency	2094.7
Structure
Chemical Formula	C₁₀H₁₈N₂O₃S
Molecular Mass	246.1038
SMILES	CSCCC(NC(=O)C1CCCN1)C(=O)O
InChI Key	MTWJTFBVRDGROD-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	alpha amino acid amides alpha amino acids amino acids azacyclic compounds carbonyl compounds carboxylic acids dialkylamines dialkylthioethers heterocyclic fatty acids hydrocarbon derivatives methionine and derivatives monocarboxylic acids and derivatives n-acyl-alpha amino acids organic oxides organopnictogen compounds proline and derivatives pyrrolidinecarboxamides secondary carboxylic acid amides sulfenyl compounds thia fatty acids
Substituents	fatty acyl carbonyl group carboxylic acid amino acid or derivatives amino acid heterocyclic fatty acid fatty acid alpha-amino acid or derivatives organosulfur compound organic oxide aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound pyrrolidine organoheterocyclic compound n-acyl-alpha amino acid or derivatives proline or derivatives secondary aliphatic amine alpha-amino acid amide sulfenyl compound azacycle n-acyl-alpha-amino acid dialkylthioether secondary amine carboxamide group alpha-dipeptide secondary carboxylic acid amide monocarboxylic acid or derivatives thia fatty acid pyrrolidine carboxylic acid or derivatives organic oxygen compound thioether methionine or derivatives hydrocarbon derivative organic nitrogen compound pyrrolidine-2-carboxamide organooxygen compound amine

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