Compound Identification
SMILES
CCOC(=O)N[C@@H](C(C)C)C(=O)NN(C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C(C)C)N(C)C(O)=O)CC1=CC=C(C=C1)C1=CC=CC=N1
InChIKey
InChIKey=VPLVAZVVELGTFK-YRCZKMHPSA-N
Formula
C37H50N6O7
Mass
690.842
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
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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
Phenylpyridines Phenylbutylamines Amphetamines and derivatives N-acyl amines Heteroaromatic compounds Carbamate esters Tertiary amines Secondary carboxylic acid amides Secondary alcohols Carboxylic acid hydrazides Carbamic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Valine or derivatives - 2-phenylpyridine - Phenylbutylamine - Amphetamine or derivatives - N-acyl-amine - Fatty amide - Monocyclic benzene moiety - Pyridine - Benzenoid - Fatty acyl - Carbamic acid ester - Heteroaromatic compound - Tertiary amine - Secondary carboxylic acid amide - Carbamic acid - Carboxylic acid hydrazide - Secondary alcohol - Carboxamide group - Carbamic acid derivative - Azacycle - Organoheterocyclic compound - Amine - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic 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