Compound Identification
SMILES
CCOC(=O)C1=C(NC(=O)CN2C(=O)SC(=CC3=CC(OCC)=C(OCC4=CC=C(Br)C=C4)C=C3)C2=O)SC2=C1CCCC2
InChIKey
InChIKey=CZRUVPCTIYXWRP-UHFFFAOYSA-N
Formula
C32H31BrN2O7S2
Mass
699.63
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
-
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
N-arylamides Phenol ethers Phenoxy compounds Thiophene carboxylic acids and derivatives Alkyl aryl ethers Thiazolidinediones Bromobenzenes Aryl bromides Heteroaromatic compounds Dicarboximides Vinylogous amides Secondary carboxylic acid amides Carboxylic acid esters Thiocarbamic acid derivatives Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Phenoxy compound - Phenol ether - Thiophene carboxylic acid or derivatives - N-arylamide - Alkyl aryl ether - Bromobenzene - Halobenzene - Thiazolidinedione - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Thiazolidine - Heteroaromatic compound - Vinylogous amide - Thiophene - Dicarboximide - Thiocarbamic acid derivative - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen 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