Compound Identification
SMILES
CC1(C)O[C@H]2O[C@H](COCC3=CC=CC=C3)[C@H](OCC3=CN(CC(O)CN=[N+]=[N-])N=N3)[C@H]2O1
InChIKey
InChIKey=XMHBLUXYZWBRGC-DGDSNLKDSA-N
Formula
C21H28N6O6
Mass
460.491
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzylethers
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzylethers
Intermediate Tree Nodes
Not available
Direct Parent
Benzylethers
Alternative Parents
Ketals Monosaccharides Triazoles Oxolanes 1,3-dioxolanes Heteroaromatic compounds Secondary alcohols Azo compounds Azo imides Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic zwitterions Organopnictogen compounds Organic salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzylether - Ketal - Monosaccharide - Meta-dioxolane - Azole - Oxolane - 1,2,3-triazole - Heteroaromatic compound - Azo compound - Azo imide - Secondary alcohol - Organoheterocyclic compound - Oxacycle - Azacycle - Acetal - Dialkyl ether - Ether - Organic salt - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alcohol - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).
External Descriptors
Not available