Compound Identification
SMILES
CC(C)(C)C1=CC2=C(OC[C@H](O2)C(=O)NNC2=C3C=C(Br)C=CC3=NC2=O)C=C1
InChIKey
InChIKey=UYMMZRIALLSZMN-KRWDZBQOSA-N
Formula
C21H20BrN3O4
Mass
458.312
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Benzo-1,4-dioxanes Indoles and derivatives Alkyl aryl ethers Para dioxins Benzenoids Aryl bromides N-acylimines Carboxylic acid hydrazides Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzo-1,4-dioxane - Benzodioxane - Indole or derivatives - Alkyl aryl ether - Aryl bromide - Aryl halide - Benzenoid - Para-dioxin - Carboxylic acid hydrazide - N-acylimine - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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