DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:02:56 UTC
Update Date	2025-03-25 00:54:41 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02207957
Frequency	0.5
Structure
Chemical Formula	C₁₄H₁₉N₃O
Molecular Mass	245.1528
SMILES	CC(C)CC1NC(NCc2ccccc2)=NC1=O
InChI Key	LEPQSNZCQSCFMZ-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	alpha amino acids
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	azacyclic compounds benzene and substituted derivatives carbonyl compounds carboximidamides carboxylic acids and derivatives guanidines hydrocarbon derivatives imidazolinones n-acylimines organic oxides organopnictogen compounds propargyl-type 1,3-dipolar organic compounds
Substituents	n-acylimine monocyclic benzene moiety carbonyl group aromatic heteromonocyclic compound guanidine propargyl-type 1,3-dipolar organic compound organic oxide organonitrogen compound alpha-amino acid organopnictogen compound imidazolinone organoheterocyclic compound azacycle organic 1,3-dipolar compound carboximidamide organic oxygen compound 2-imidazoline imidazoline hydrocarbon derivative benzenoid organic nitrogen compound organooxygen compound

Showing information for DMID02207957