Compound Identification
SMILES
CC1=CC(C)=NC(O[C@H](C(O)=O)[C@]2(NCC3=NN=C(N3C3=CC=CC=C23)C(O)=O)C2=CC=CC=C2)=N1
InChIKey
InChIKey=GNSZRIDFQRHNDW-NLFFAJNJSA-N
Formula
C25H22N6O5
Mass
486.488
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
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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
Phenylpropanoic acids Aralkylamines Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Benzene and substituted derivatives Triazoles Heteroaromatic compounds Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpropanoic-acid - 1,4-benzodiazepine - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - 1,2,4-triazole - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Azacycle - Secondary amine - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - 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