Compound Identification
SMILES
O=C1N[C@@H](CC2=CC=CC=C2)C(=O)N2[C@H]1C[C@]1([C@@H]2NC2=CC=CC=C12)[C@]12C[C@@H]3N([C@H]1NC1=CC=CC=C21)C(=O)[C@H](CC1=CC=CC=C1)NC3=O
InChIKey
InChIKey=ZEANERNKMXBETI-BJHDJDSNSA-N
Formula
C40H36N6O4
Mass
664.766
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
- Subclass Pyrroloindoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyrroloindoles
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloindoles
Alternative Parents
Alpha amino acids and derivatives Indoles Indolines 2,5-dioxopiperazines Secondary alkylarylamines N-alkylpiperazines Benzene and substituted derivatives Tertiary carboxylic acid amides Pyrrolidines Pyrroles Secondary carboxylic acid amides Lactams Azacyclic compounds Carbonyl compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrroloindole - Alpha-amino acid or derivatives - Indole - Dihydroindole - Dioxopiperazine - 2,5-dioxopiperazine - Secondary aliphatic/aromatic amine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Pyrrole - Amino acid or derivatives - Secondary carboxylic acid amide - Lactam - Carboxamide group - Azacycle - Secondary amine - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Amine - Organopnictogen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloindoles. These are compounds containing a pyrroloindole moiety, which is a tricyclic heterocycle which consists of a pyrrole ring fused to an indole. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Indole is a bicyclic compound consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available