Compound Identification
SMILES
Cl.CCOC1=C(NC(C)C)C=CC(=C1)C(NC1=CC=C(C=C1)C(N)=N)C([O-])=O
InChIKey
InChIKey=WOBMNSVHGNFCAB-UHFFFAOYSA-M
Formula
C20H26ClN4O3
Mass
405.9
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 Alpha amino acids
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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
Alpha amino acids
Alternative Parents
Phenylisopropylamines Aminophenyl ethers Phenoxy compounds Aniline and substituted anilines Secondary alkylarylamines Alkyl aryl ethers Amino acids Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Carboxamidines Organic oxides Carbonyl compounds Hydrocarbon derivatives Hydrochlorides Organic anions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylisopropylamine - Alpha-amino acid - Aminophenyl ether - Phenoxy compound - Phenylalkylamine - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Amino acid - Carboxylic acid salt - Amidine - Carboxylic acid amidine - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Secondary amine - Carboximidamide - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrochloride - Organic oxide - Carbonyl group - Organic anion - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
External Descriptors
Not available