Compound Identification
SMILES
CCOC(=O)CN1C(=O)N(CC2=CC=CC=C2SC)C2=C(C(CNS(C)(=O)=O)=C(S2)C2=CC=C(OCC=C)C=C2)C1=O
InChIKey
InChIKey=JVKZKDBQCXJHFS-UHFFFAOYSA-N
Formula
C29H31N3O7S3
Mass
629.76
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
Thienopyrimidines Thiophenol ethers Phenol ethers Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Pyrimidones Organic sulfonamides Organosulfonamides Vinylogous amides Heteroaromatic compounds Aminosulfonyl compounds Thiophenes Ureas Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Sulfenyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Thienopyrimidine - Phenoxy compound - Aryl thioether - Phenol ether - Thiophenol ether - Alkyl aryl ether - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Sulfonyl - Thiophene - Aminosulfonyl compound - Urea - Carboxylic acid ester - Lactam - Ether - Organoheterocyclic compound - Azacycle - Thioether - Sulfenyl compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - 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