Compound Identification
SMILES
C[C@@H]1C2=CC([C@@H](C)C3=CC([C@@H](C)C4=C(O)C=C(O)C(=C4)[C@H](C)C4=C(OC(=O)C5=CC=CC=C5C(C)=O)C=C(OC(=O)C5=CC=CC=C5C(C)=O)C1=C4)=C(OC(=O)C1=CC=CC=C1C(C)=O)C=C3OC(=O)C1=CC=CC=C1C(C)=O)=C(O)C=C2O
InChIKey
InChIKey=SLHJEKFDRRFTNF-IHAKKMGISA-N
Formula
C68H56O16
Mass
1129.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl 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 - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Phenol esters Benzoic acid esters Acetophenones Benzoyl derivatives Aryl alkyl ketones 1-hydroxy-2-unsubstituted benzenoids Carboxylic acid esters Polyols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Alkyl-phenylketone - Benzoate ester - Phenol ester - Acetophenone - Benzoic acid or derivatives - Aryl alkyl ketone - Benzoyl - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Monocyclic benzene moiety - Carboxylic acid ester - Polyol - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available