Compound Identification
SMILES
CC(=O)COC(=O)CN1C(=S)N(C(=O)C1=CC=C1OC2=CC=CC=C2N1CCCCS(O)(=O)=O)C1=CC=CC=C1
InChIKey
InChIKey=ZPAWFUYEZPIHGF-UHFFFAOYSA-N
Formula
C27H27N3O8S2
Mass
585.65
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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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
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Level 6
Alpha amino acids and derivatives
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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 Alpha-acyloxy ketones Imidazolidinones Alkanesulfonic acids Sulfonyls Organosulfonic acids Ketones Ketene acetals Carboxylic acid esters Thioureas Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Phenylimidazolidine - N-phenylthiourea - Benzoxazoline - Alpha-acyloxy ketone - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Imidazolidine - Alkanesulfonic acid - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Carboxylic acid ester - Ketene acetal or derivatives - Ketone - Thiourea - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Azacycle - Organonitrogen compound - Organic oxide - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - 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