Compound Identification
SMILES
CC(C)(C=C)[C@]12NC3=C(C=CC4=C3OC(C)(C)C=C4)[C@]1(O)C[C@H]1N2C(=O)[C@H]2CCCN2C1=O
InChIKey
InChIKey=IDMNDTVGFAYTCQ-AMDOOTJESA-N
Formula
C26H31N3O4
Mass
449.551
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Pyrroloindoles
-
Class
Indoles and derivatives
-
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
2,2-dimethyl-1-benzopyrans Alpha amino acids and derivatives Indoles Indolines 2,5-dioxopiperazines Alkyl aryl ethers Secondary alkylarylamines N-alkylpiperazines Benzenoids Tertiary carboxylic acid amides Tertiary alcohols Pyrrolidines Pyrroles Tertiary amines Lactams Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,2-dimethyl-1-benzopyran - Pyrroloindole - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - Indole - Dihydroindole - Dioxopiperazine - 2,5-dioxopiperazine - Alkyl aryl ether - N-alkylpiperazine - Secondary aliphatic/aromatic amine - 1,4-diazinane - Benzenoid - Piperazine - Tertiary carboxylic acid amide - Pyrrole - Pyrrolidine - Tertiary alcohol - Tertiary amine - Amino acid or derivatives - Carboxamide group - Lactam - Secondary amine - Carboxylic acid derivative - Oxacycle - Ether - Azacycle - Amine - Organonitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Alcohol - 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