Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C(C)C(C(O)=O)C(=O)C(O)=O
InChIKey
InChIKey=DLBCTFGHLRLHQU-UHFFFAOYSA-N
Formula
C15H18O8
Mass
326.301
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Phenylpropanoic acids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Phenylpropanoic acids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropanoic acids
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Beta-keto acids and derivatives Alkyl aryl ethers Dicarboxylic acids and derivatives Beta-hydroxy ketones Alpha-keto acids and derivatives 1,3-dicarbonyl compounds Alpha-hydroxy ketones Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Beta-keto acid - Alpha-keto acid - Monocyclic benzene moiety - Beta-hydroxy ketone - Dicarboxylic acid or derivatives - Keto acid - Benzenoid - 1,3-dicarbonyl compound - Alpha-hydroxy ketone - Ketone - Carboxylic acid - Carboxylic acid derivative - Ether - Carbonyl group - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
External Descriptors
Not available