Compound Identification
SMILES
CC(C)[C@H](NC(C)(C)C)C(=O)NC(=O)[C@@H]1CCC[N+]11C([O-])[C@H](CC2=CC=CC=C2)NC(=O)N1CC1=CC=CC=C1
InChIKey
InChIKey=UZPHZRJBKKXERF-HLELOWJYSA-N
Formula
C31H43N5O4
Mass
549.716
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
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 Pyrrolidinecarboxamides Triazinones 1,2,4-triazinanes 1,2,4-triazines N-alkylpyrrolidines N-acyl amines Benzene and substituted derivatives Semicarbazides N-unsubstituted carboxylic acid imides Dicarboximides Azacyclic compounds Dialkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Alkoxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - Alpha-amino acid amide - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Triazinone - 1,2,4-triazinane - Monocyclic benzene moiety - N-acyl-amine - 1,2,4-triazine - Triazinane - Benzenoid - Triazine - N-alkylpyrrolidine - Carboxylic acid imide - Dicarboximide - Carboxylic acid imide, n-unsubstituted - Pyrrolidine - Semicarbazide - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Secondary amine - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic salt - Organic zwitterion - Alkoxide - 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