Compound Identification
SMILES
COC(=O)C(CSC1=C(C)C=C(C)C=C1)N1C(=O)N2CC=CC(N2C1=O)C(=O)NCC1CCC(N)CC1
InChIKey
InChIKey=OPVOSNOJNHCKLH-UHFFFAOYSA-N
Formula
C26H35N5O5S
Mass
529.66
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
-
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
Triazolopyridazines m-Xylenes Thiophenol ethers Urazoles Alkylarylthioethers Cyclohexylamines Pyridazines and derivatives Triazoles Heteroaromatic compounds Methyl esters Secondary carboxylic acid amides Azacyclic compounds Sulfenyl compounds Monocarboxylic acids and derivatives Monoalkylamines Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Triazolopyridazine - Aryl thioether - Thiophenol ether - M-xylene - Xylene - Urazole - Alkylarylthioether - Cyclohexylamine - Benzenoid - Pyridazine - Monocyclic benzene moiety - Azole - 1,2,4-triazole - Methyl ester - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Sulfenyl compound - Thioether - Organonitrogen compound - Primary aliphatic amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxygen compound - Organic oxide - 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