Compound Identification
SMILES
CCOC(=O)CN1C(SC2=C1C=CC(=C2)[N+]([O-])=O)=NC(=O)CS(=O)(=O)CC(=O)NC1=C(C(=O)OC)C2=C(CC(C)CC2)S1
InChIKey
InChIKey=GEPHLEZVXVTYGI-UHFFFAOYSA-N
Formula
C26H28N4O10S3
Mass
652.71
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
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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
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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
Benzothiazoles Thiophene carboxylic acids and derivatives Nitroaromatic compounds N-arylamides Benzenoids Vinylogous amides Thiazoles Sulfones Heteroaromatic compounds Methyl esters Secondary carboxylic acid amides Isothioureas N-acylimines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organic salts Hydrocarbon derivatives Organic zwitterions Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - 1,3-benzothiazole - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - N-arylamide - Benzenoid - Azole - Sulfone - Heteroaromatic compound - Sulfonyl - Thiazole - Vinylogous amide - Thiophene - Methyl ester - Carboxamide group - Carboxylic acid ester - Isothiourea - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - N-acylimine - Allyl-type 1,3-dipolar organic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic oxygen compound - Organosulfur compound - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic zwitterion - 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