Compound Identification
SMILES
CC(C)OC(=O)C1CCCN1S(=O)(=O)C1=CC=C(C=C1)N1CCC(CC1)NCC(O)COC1=CC=CC2=C1NC(=O)N2
InChIKey
InChIKey=YNUVXEZMKAOYGC-UHFFFAOYSA-N
Formula
C29H39N5O7S
Mass
601.72
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
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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
Proline and derivatives Phenylpiperidines Aminobenzenesulfonamides Benzenesulfonyl compounds Benzimidazoles Aniline and substituted anilines Dialkylarylamines Phenol ethers Pyrrolidine carboxylic acids Alkyl aryl ethers Aminopiperidines Organosulfonamides Imidazoles Heteroaromatic compounds Sulfonyls Carboxylic acid esters Secondary alcohols 1,2-aminoalcohols Ureas Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Proline or derivatives - Phenylpiperidine - Aminobenzenesulfonamide - Benzenesulfonamide - Benzenesulfonyl group - Benzimidazole - Aniline or substituted anilines - Dialkylarylamine - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - 4-aminopiperidine - Monocyclic benzene moiety - Benzenoid - Piperidine - Organosulfonic acid amide - Sulfonyl - Pyrrolidine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - Tertiary amine - Urea - 1,2-aminoalcohol - Carboxylic acid ester - Secondary amine - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Alcohol - Amine - 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