Compound Identification
SMILES
OC(=O)CCC(=O)O[C@H](C(=O)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=JIXPXNUZJCCKGO-SFHVURJKSA-N
Formula
C18H16O5
Mass
312.321
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Stilbenes
Subclass
Benzoins
Intermediate Tree Nodes
Not available
Direct Parent
Benzoins
Alternative Parents
Alkyl-phenylketones Benzyloxycarbonyls Benzoyl derivatives Aryl alkyl ketones Fatty acid esters Alpha-acyloxy ketones Dicarboxylic acids and derivatives Carboxylic acid esters Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoin - Alkyl-phenylketone - Benzyloxycarbonyl - Phenylketone - Benzoyl - Aryl alkyl ketone - Aryl ketone - Alpha-acyloxy ketone - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Dicarboxylic acid or derivatives - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoins. These are organic compounds containing a 1,2-hydroxy ketone attached to two phenyl groups.
External Descriptors
Not available