DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:59:21 UTC
Update Date	2025-03-25 00:53:28 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02199766
Frequency	0.5
Structure
Chemical Formula	C₂₂H₃₂N₆O
Molecular Mass	396.2638
SMILES	N=C(N)NCCCC(N)C(=O)NC(Cc1ccccc1)C(N)Cc1ccccc1
InChI Key	SLCOIDBAJYHUJW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	lignans, neolignans and related compounds
Class	Not Available
Subclass	lignans, neolignans and related compounds
Direct Parent	lignans, neolignans and related compounds
Geometric Descriptor	aromatic homomonocyclic compounds
Alternative Parents	alpha amino acid amides alpha amino acids amphetamines and derivatives arginine and derivatives benzene and substituted derivatives carbonyl compounds carboximidamides carboxylic acids and derivatives guanidines hydrocarbon derivatives imines monoalkylamines n-acyl amines organic oxides organopnictogen compounds secondary carboxylic acid amides
Substituents	fatty acyl monocyclic benzene moiety carbonyl group guanidine imine fatty amide norlignan skeleton alpha-amino acid or derivatives carboxylic acid derivative organic oxide arginine or derivatives organonitrogen compound alpha-amino acid organopnictogen compound amphetamine or derivatives alpha-amino acid amide carboximidamide carboxamide group n-acyl-amine aromatic homomonocyclic compound secondary carboxylic acid amide organic oxygen compound hydrocarbon derivative benzenoid primary aliphatic amine organic nitrogen compound organooxygen compound

Showing information for DMID02199766