Compound Identification
SMILES
CC[N+](CC)=CC.CC(=O)COC(=O)CN1C(=S)N(C(=O)C1=CC=C1OC2=CC=CC=C2N1CCCCS([O-])(=O)=O)C1=CC=CC=C1
InChIKey
InChIKey=SABZZIIUJPYELU-UHFFFAOYSA-M
Formula
C33H40N4O8S2
Mass
684.82
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
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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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 Sulfonyls Alkanesulfonic acids Organosulfonic acids Thioureas Shiff bases Carboxylic acid esters Ketones Ketene acetals Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Amines Organic cations
Molecular Framework
Not available
Substituents
Alpha-amino acid ester - Phenylimidazolidine - N-phenylthiourea - Benzoxazoline - Alpha-acyloxy ketone - Monocyclic benzene moiety - Imidazolidinone - Benzenoid - Imidazolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Alkanesulfonic acid - Sulfonyl - Carboxylic acid ester - Ketene acetal or derivatives - Ketone - Shiff base - Thiourea - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic cation - 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