Compound Identification
SMILES
OC(=O)[C@@H](OC(=O)C1=CC=CC=C1)[C@@H](OC(=O)C1=CC=CC=C1)C(O)=O.CN1CCN(CC1)C(=O)O[C@@H]1N(C(=O)C2=NC=CN=C12)C1=NC=C(Cl)C=C1
InChIKey
InChIKey=VWHOMASMFLCMFN-DOZIDKIMSA-N
Formula
C35H31ClN6O11
Mass
747.11
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolopyrazines
- Subclass Cyclopyrrolones
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Class
Pyrrolopyrazines
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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 Benzoyl derivatives 2-heteroaryl carboxamides N-methylpiperazines Pyridines and derivatives Pyrazines Aryl chlorides Monosaccharides Imidolactams Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Carbamate esters Heteroaromatic compounds Trialkylamines Lactams Carboxylic acid esters Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Not available
Substituents
Cyclopyrrolone - Benzoate ester - Piperazine-1-carboxylic acid - Benzoic acid or derivatives - 2-heteroaryl carboxamide - Benzoyl - N-methylpiperazine - N-alkylpiperazine - Monosaccharide - Dicarboxylic acid or derivatives - 1,4-diazinane - Benzenoid - Imidolactam - Monocyclic benzene moiety - Aryl halide - Pyridine - Pyrazine - Piperazine - Aryl chloride - Heteroaromatic compound - Tertiary carboxylic acid amide - Carbamic acid ester - 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