Compound Identification
SMILES
COC1=CC=CC(=C1)C1C(C(N(C1C(N)=O)C(=O)C1=CC=CC=C1)C1=CC2=C(OCO2)C=C1)C(=O)C1=CC=C(Cl)S1
InChIKey
InChIKey=HTAJBARCKVJFBP-UHFFFAOYSA-N
Formula
C31H25ClN2O6S
Mass
589.06
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
-
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
Proline and derivatives
Alternative Parents
Alpha amino acid amides Phenylpyrrolidines Benzamides Benzodioxoles Aryl alkyl ketones Pyrrolidinecarboxamides Benzoyl derivatives Anisoles Methoxybenzenes N-acylpyrrolidines Phenoxy compounds Alkyl aryl ethers 2,5-disubstituted thiophenes Aryl chlorides Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Acetals Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Aldehydes Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - 2-phenylpyrrolidine - 3-phenylpyrrolidine - Benzamide - Benzodioxole - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - N-acylpyrrolidine - Phenol ether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - 2,5-disubstituted thiophene - Alkyl aryl ether - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Pyrrole - Thiophene - Primary carboxylic acid amide - Carboxamide group - Ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Acetal - Ether - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aldehyde - Organochloride - Carbonyl group - Organohalogen compound - Organic nitrogen 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