Compound Identification
SMILES
CC(C)[C@H](NC(=O)[C@@H]1CC2=CC=CC=C2CN1C(=O)[C@@H](N)CC1=CNC2=CC=CC=C12)C(O)=O
InChIKey
InChIKey=YRFIFTHRGXXMRL-PMVMPFDFSA-N
Formula
C26H30N4O4
Mass
462.55
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Valine and derivatives
-
Level 6
Alpha amino acids and derivatives
-
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
Valine and derivatives
Alternative Parents
N-acyl-L-alpha-amino acids Tryptamines and derivatives Alpha amino acid amides Tetrahydroisoquinolines 3-alkylindoles Aralkylamines Substituted pyrroles Benzenoids Heteroaromatic compounds Tertiary carboxylic acid amides Tertiary amines Amino acids Secondary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - N-acyl-l-alpha-amino acid - Alpha-amino acid amide - Triptan - Tetrahydroisoquinoline - 3-alkylindole - Indole - Indole or derivatives - Aralkylamine - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Tertiary amine - Amino acid - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Primary aliphatic amine - Organic oxide - Organic oxygen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available