Compound Identification
SMILES
COC1=CC=CC=C1OC(CO[C@@H]1OC[C@@H](OC(=O)C2=CC=CC=C2)[C@H](OC(=O)C2=CC=CC=C2)[C@H]1OC(=O)C1=CC=CC=C1)C(=O)C1=CC(OC)=C(OCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=ZSIFHUASXPQZEP-XXOUJMJESA-N
Formula
C50H44O13
Mass
852.889
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
Disaccharides O-glycosyl compounds Benzoic acid esters Tricarboxylic acids and derivatives Anisoles Aryl alkyl ketones Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Oxanes Carboxylic acid esters Acetals Oxacyclic compounds Hydrocarbon derivatives Aldehydes Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzoate ester - Benzoic acid or derivatives - Tricarboxylic acid or derivatives - Aryl alkyl ketone - Methoxybenzene - Phenol ether - Anisole - Phenoxy compound - Benzoyl - Alkyl aryl ether - Benzenoid - Oxane - Monocyclic benzene moiety - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Acetal - Organoheterocyclic compound - Ether - Hydrocarbon derivative - Aldehyde - Organic oxide - Aromatic heteromonocyclic 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