Compound Identification
SMILES
CN1CCN(CC1)C(=O)O[C@@H]1N(C(=O)C2=NC=CN=C12)C1=NC=C(Cl)C=C1.CC1=CC=C(C=C1)C(=O)O[C@@H]([C@@H](OC(=O)C1=CC=C(C)C=C1)C(O)=O)C(O)=O
InChIKey
InChIKey=HWZWPINKLQELEO-IFSMGKKDSA-N
Formula
C37H35ClN6O11
Mass
775.17
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolopyrazines
- Subclass Cyclopyrrolones
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Class
Pyrrolopyrazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrazines
Subclass
Cyclopyrrolones
Intermediate Tree Nodes
Not available
Direct Parent
Cyclopyrrolones
Alternative Parents
Benzoic acid esters Piperazine carboxylic acids 2-heteroaryl carboxamides Benzoyl derivatives Toluenes N-methylpiperazines Aryl chlorides Pyridines and derivatives Dicarboxylic acids and derivatives Imidolactams Monosaccharides Pyrazines Heteroaromatic compounds Tertiary carboxylic acid amides Carbamate esters Carboxylic acid esters Lactams Trialkylamines Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Not available
Substituents
Cyclopyrrolone - Benzoate ester - Piperazine-1-carboxylic acid - Benzoic acid or derivatives - 2-heteroaryl carboxamide - Benzoyl - Toluene - N-methylpiperazine - N-alkylpiperazine - Monosaccharide - Dicarboxylic acid or derivatives - 1,4-diazinane - Benzenoid - Imidolactam - Monocyclic benzene moiety - Aryl halide - Pyridine - Pyrazine - Piperazine - Aryl chloride - Carbamic acid ester - Tertiary carboxylic acid amide - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Carboxylic acid ester - Tertiary amine - Lactam - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclopyrrolones. These are compounds belonging to a family of pyridin-2-ylpyrrole based chemicals. The pyrrole is usually fused to a benzene, pyrimidine, or dithiin.
External Descriptors
Not available