Compound Identification
SMILES
COC1=CC=CC(NC(=O)CC(=O)N2NC(C)C(N=NC3=CC=CC(=C3)C(O)=O)C2=O)=C1
InChIKey
InChIKey=TYEJEAXUAYHKNK-UHFFFAOYSA-N
Formula
C21H21N5O6
Mass
439.428
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Anilides Methoxyanilines Benzoic acids Phenoxy compounds N-arylamides Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers 1,3-dicarbonyl compounds Pyrazolidinones Dicarboximides Secondary carboxylic acid amides Azo compounds Carboxylic acid hydrazides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzoic acid or derivatives - Methoxyaniline - Anilide - Benzoic acid - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Phenol ether - N-arylamide - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - 1,3-dicarbonyl compound - Pyrazolidinone - Dicarboximide - Pyrazolidine - Secondary carboxylic acid amide - Azo compound - Carboxylic acid hydrazide - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Ether - Azacycle - Carboxylic acid - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available