Compound Identification
SMILES
CC(C)OCC(O)COC1=CC(=O)\C(C=C1)=C1\NC(=N\C(N1)=C1\C=CC(OCC(O)COC(C)C)=CC1=O)C1=CC=CC=C1
InChIKey
InChIKey=LBEQQEQGHYGSHJ-RLLWZUHKSA-N
Formula
C33H39N3O8
Mass
605.688
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
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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
Glycerol ethers 1,3,5-triazines Benzene and substituted derivatives Imidolactams Vinylogous esters Vinylogous amides Secondary alcohols Ketene acetals Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboxamidines Dialkyl ethers Carboximidamides Organic oxides Amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Glycerol ether - Glycerolipid - Monocyclic benzene moiety - Triazine - 1,3,5-triazine - Benzenoid - Imidolactam - Vinylogous ester - Vinylogous amide - Secondary alcohol - Ketene acetal or derivatives - Propargyl-type 1,3-dipolar organic compound - Amidine - Organoheterocyclic compound - Azacycle - Carboximidamide - Organic 1,3-dipolar compound - Carboxylic acid amidine - Dialkyl ether - Ether - Alcohol - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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