Compound Identification
SMILES
COC1=C(CCNC(=O)[C@H](CCCCCC(C)=O)NC(=O)C2CCCCN2C)C=C2C(NC3=CC=CC(=C3)C#C)=NC=NC2=C1
InChIKey
InChIKey=IVROKWPWVXEJOT-QHSFNAQHSA-N
Formula
C35H44N6O4
Mass
612.775
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Quinazolinamines Piperidinecarboxamides Aniline and substituted anilines Anisoles Alkyl aryl ethers Aminopyrimidines and derivatives N-acyl amines Imidolactams Heteroaromatic compounds Ketones Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Acetylides Secondary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Quinazolinamine - Quinazoline - 2-piperidinecarboxamide - Piperidinecarboxamide - Anisole - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Aminopyrimidine - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Piperidine - Pyrimidine - Imidolactam - Benzenoid - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ketone - Carboxamide group - Acetylide - Azacycle - Secondary amine - Organoheterocyclic compound - Ether - Carbonyl group - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available