Compound Identification
SMILES
COC(=O)N[C@@H](CSC)C(=O)NN(C[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)OC)C(C)C)CC1=CC=C(C=C1)C1=CN=CS1
InChIKey
InChIKey=APTIZNCZOZNDMV-QFVIIZQESA-N
Formula
C33H44N6O7S2
Mass
700.87
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
Alpha amino acid amides Cysteine and derivatives Phenylbutylamines Amphetamines and derivatives N-acyl amines Thiazoles Methylcarbamates Heteroaromatic compounds Secondary alcohols Secondary carboxylic acid amides Organic carbonic acids and derivatives Carboxylic acid hydrazides Azacyclic compounds Dialkylthioethers Sulfenyl compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Cysteine or derivatives - Phenylbutylamine - Amphetamine or derivatives - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Benzenoid - Fatty acyl - Methylcarbamate - Azole - Thiazole - Carbamic acid ester - Heteroaromatic compound - Secondary carboxylic acid amide - Secondary alcohol - Carboxamide group - Carboxylic acid hydrazide - Carbonic acid derivative - Azacycle - Thioether - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Alcohol - Hydrocarbon derivative - 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