Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OCC1=CN=CS1)S(=O)(=O)C1=CC2=C(C=C1)N=C(NC(=O)C1CCC(=O)N1)S2
InChIKey
InChIKey=MCKQOYUYKPPOGC-XBCLTQTASA-N
Formula
C31H36N6O7S3
Mass
700.84
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 Proline and derivatives
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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
Proline and derivatives
Alternative Parents
Alpha amino acid amides Phenylbutylamines Amphetamines and derivatives Benzothiazoles N-arylamides Pyrrolidinecarboxamides Organosulfonamides Pyrrolidine-2-ones Thiazoles Heteroaromatic compounds Carbamate esters Aminosulfonyl compounds Organic carbonic acids and derivatives Lactams Secondary alcohols Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - 1,3-benzothiazole - Pyrrolidine-2-carboxamide - N-arylamide - Pyrrolidine carboxylic acid or derivatives - Benzenoid - 2-pyrrolidone - Organosulfonic acid amide - Pyrrolidone - Monocyclic benzene moiety - Pyrrolidine - Aminosulfonyl compound - Carbamic acid ester - Thiazole - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azole - Heteroaromatic compound - Carboxamide group - Lactam - Carbonic acid derivative - Secondary carboxylic acid amide - Secondary alcohol - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available