DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:45:18 UTC
Update Date	2025-03-25 00:48:22 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02167739
Frequency	0.5
Structure
Chemical Formula	C₁₉H₃₄N₄O₂
Molecular Mass	350.2682
SMILES	CC(C)NCC(O)C(Cc1ccccc1)NC(=O)C(N)CCCCN
InChI Key	YZZCEONEHZDVHF-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 acid amides
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alpha amino acids amphetamines and derivatives carbonyl compounds carboxylic acids and derivatives dialkylamines hydrocarbon derivatives monoalkylamines n-acyl amines organic oxides organopnictogen compounds phenylbutylamines secondary alcohols secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group fatty amide organic oxide phenylbutylamine organonitrogen compound alpha-amino acid organopnictogen compound amphetamine or derivatives alcohol secondary aliphatic amine alpha-amino acid amide secondary amine carboxamide group n-acyl-amine aromatic homomonocyclic compound secondary carboxylic acid amide organic oxygen compound secondary alcohol hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound amine

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