Compound Identification
SMILES
CCC(C)[C@H](OC(N)=O)C(=O)N1CCC[C@H]1C1=NC2=C(N1)C=C(C=C2)[C@H]1CC[C@@H](N1C1=CN=C(C=C1)N1CCCCC1)C1=CC2=C(C=C1)N=C(N2)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C
InChIKey
InChIKey=QLQVMZLXXXNHMV-TVIJIMDKSA-N
Formula
C50H65N11O6
Mass
916.141
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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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
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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 Phenylpyrrolidines Benzimidazoles N-acylpyrrolidines Dialkylarylamines Aminopyridines and derivatives Aralkylamines Piperidines Monosaccharides Benzenoids Imidolactams Tertiary carboxylic acid amides Pyrroles Methylcarbamates Imidazoles Heteroaromatic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - 2-phenylpyrrolidine - Benzimidazole - N-acylpyrrolidine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Aminopyridine - Aralkylamine - Monosaccharide - Piperidine - Pyridine - Imidolactam - Benzenoid - Methylcarbamate - Azole - Imidazole - Heteroaromatic compound - Pyrrole - Pyrrolidine - Carbamic acid ester - Tertiary carboxylic acid amide - Tertiary amine - Carboxamide group - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Organic oxygen compound - Carbonyl group - 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