Compound Identification
SMILES
O[C@@H]1[C@@H](O)[C@@H](CC2=CC=CC=C2)N(CCCCCNC(=O)CC2=CN=CC=C2)C(=O)N(CCCCCNC(=O)CC2=CN=CC=C2)[C@@H]1CC1=CC=CC=C1
InChIKey
InChIKey=CHKJHBSKSVTXCY-VNXDFUDDSA-N
Formula
C43H54N6O5
Mass
734.942
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazepanes
- Subclass 1,3-diazepanes
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Class
Diazepanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazepanes
Subclass
1,3-diazepanes
Intermediate Tree Nodes
Not available
Direct Parent
1,3-diazepanes
Alternative Parents
Pyridines and derivatives Benzene and substituted derivatives Heteroaromatic compounds Ureas Secondary carboxylic acid amides Secondary alcohols 1,2-diols Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1,3-diazepane - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - 1,2-diol - Carboxamide group - Urea - Secondary carboxylic acid amide - Secondary alcohol - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Alcohol - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-diazepanes. These are diazepanes having the two nitrogen atoms at position 1 and 3 of the diazepane ring.
External Descriptors
Not available