Compound Identification
SMILES
COC(=O)CCCCOC1=CC(COC2=C(OC)C=C3C(=C2)N=C[C@@H]2CC4=CC=CC=C4N2C3=O)=CC(COC2=C(OC)C=C3C(=C2)N=C[C@@H]2CC4=CC=CC=C4N2C3=O)=C1
InChIKey
InChIKey=CJYFRSBMGDGGPR-HEVIKAOCSA-N
Formula
C48H44N4O9
Mass
820.899
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
-
Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Indoles and derivatives Phenoxy compounds Anisoles Alkyl aryl ethers Fatty acid methyl esters Tertiary carboxylic acid amides Methyl esters Tertiary amines Lactams Amino acids and derivatives Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Imines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Indole or derivatives - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Fatty acid methyl ester - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Tertiary carboxylic acid amide - Methyl ester - Lactam - Tertiary amine - Carboxamide group - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Imine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available