Compound Identification
SMILES
COC1=CC=CC2=C(N=C(Cl)C=C12)C(=O)N1CCC[C@H]1C1=NC2=C(N1)C=C(C=C2)C1=CN=C(O1)C1=CC(=CC=C1)[N+]1(CCC[C@H]1C(N)=O)C(=O)C1=C2C=CC=C(OC)C2=CC(Cl)=N1
InChIKey
InChIKey=IBQMIACZFSYOOC-HAVJPGSPSA-O
Formula
C47H39Cl2N8O6
Mass
882.78
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 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 Phenyl-1,3-oxazoles Phenylpyrrolidines Isoquinolines and derivatives Benzimidazoles Pyridinecarboxylic acids and derivatives Anisoles N-acylpyrrolidines 2-heteroaryl carboxamides Pyrrolidinecarboxamides Alkyl aryl ethers 2,5-disubstituted oxazoles 2-halopyridines Benzene and substituted derivatives Aryl chlorides Imidazoles Tertiary carboxylic acid amides Heteroaromatic compounds Pyrroles Primary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - 1-phenylpyrrolidine - Phenyl-1,3-oxazole - Isoquinoline - Benzimidazole - Pyridine carboxylic acid or derivatives - Anisole - Phenol ether - N-acylpyrrolidine - 2-heteroaryl carboxamide - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - 2-halopyridine - Alkyl aryl ether - 2,5-disubstituted 1,3-oxazole - Benzenoid - Pyridine - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Azole - Pyrrole - Imidazole - Heteroaromatic compound - Oxazole - Pyrrolidine - Tertiary carboxylic acid amide - Primary carboxylic acid amide - Carboxamide group - Ether - Organoheterocyclic compound - Azacycle - Oxacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Organic cation - 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