Compound Identification
SMILES
C[C@@H]1CCC2[C@@H](C)C(OCCN3C=C(N=N3)C(=O)NN\C=C3/C=CC=CC3=O)O[C@@H]3CC4(C)CCC1[C@@]23OO4
InChIKey
InChIKey=UBAGCLMCKFLFLU-CAYOCKGHSA-N
Formula
C28H37N5O6
Mass
539.633
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
Oxanes 1,2-dioxanes Vinylogous amides Triazoles Heteroaromatic compounds Dialkyl peroxides Carboxylic acid hydrazides Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-quinomethane - Ortho-dioxane - Oxane - Azole - Heteroaromatic compound - 1,2,3-triazole - Vinylogous amide - Carboxylic acid hydrazide - Dialkyl peroxide - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aldehyde - Organopnictogen compound - Aromatic heteropolycyclic 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