Compound Identification
SMILES
CC(=O)C1=C2OC3=CC(=O)\C(=C(\C)NCCN\C(C)=C4/C(=O)C=C5OC6=C(C(C)=O)C(O)=C(C)C(O)=C6[C@@]5(C)C4=O)C(=O)[C@]3(C)C2=C(O)C(C)=C1O
InChIKey
InChIKey=CMSIEVSKFKWARG-FXXOKKSVSA-N
Formula
C38H36N2O12
Mass
712.708
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Acetophenones
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Acetophenones
Intermediate Tree Nodes
Not available
Direct Parent
Acetophenones
Alternative Parents
Coumarans O-quinomethanes Aryl alkyl ketones Phenols Cyclohexenones Vinylogous esters Vinylogous amides Vinylogous acids Oxacyclic compounds Enamines Dialkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acetophenone - Coumaran - O-quinomethane - Quinomethane - Aryl ketone - Aryl alkyl ketone - Phenol - Cyclohexenone - Vinylogous ester - Vinylogous amide - Vinylogous acid - Ketone - Cyclic ketone - Secondary amine - Enamine - Secondary aliphatic amine - Oxacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as acetophenones. These are organic compounds containing the acetophenone structure.
External Descriptors
Not available