Compound Identification
SMILES
CCOC(=O)CN1C(=S)N(C(=O)\C1=C/C=C1\OC2=CC=CC=C2N1CCCCS(O)(=O)=O)C1=CC=CC=C1
InChIKey
InChIKey=NDFYJRKWWDRMEM-XDWHAMKHSA-N
Formula
C26H27N3O7S2
Mass
557.64
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 acid esters
-
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 acid esters
Alternative Parents
Phenylimidazolidines N-phenylthioureas Benzoxazolines Imidazolidinones Sulfonyls Alkanesulfonic acids Organosulfonic acids Thioureas Tertiary amines Carboxylic acid esters Ketene acetals Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Phenylimidazolidine - N-phenylthiourea - Benzoxazoline - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Imidazolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Thiourea - Tertiary amine - Carboxylic acid ester - Ketene acetal or derivatives - Organoheterocyclic compound - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organosulfur compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available