Compound Identification
SMILES
CCCCCCCCN(CCCCCCCC)C1=CC(=O)\C(C=C1)=C1/C(O)=C(/C=C/C2=C(C)NC(S2)=[N+](CCCCCCCC)CCCCCCCC)C1=O
InChIKey
InChIKey=QBDWCIRLVCOLTJ-ULIFNZDWSA-O
Formula
C48H78N3O3S
Mass
777.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 O-quinomethanes
-
Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
O-quinomethanes
Alternative Parents
Vinylogous amides Vinylogous acids Thiazoles Heteroaromatic compounds Trialkylamines Enols Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Azole - Heteroaromatic compound - Thiazole - Vinylogous amide - Vinylogous acid - Tertiary amine - Tertiary aliphatic amine - Enamine - Enol - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.
External Descriptors
Not available