Compound Identification
SMILES
COC1=CC(CC(O)(C(O)C(O)=O)C(O)=O)=CC=C1O
InChIKey
InChIKey=DDSGTDZCSPMYIM-UHFFFAOYSA-N
Formula
C12H14O8
Mass
286.236
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
Methoxyphenols Phenoxy compounds Anisoles Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Beta hydroxy acids and derivatives Alpha hydroxy acids and derivatives Monosaccharides Dicarboxylic acids and derivatives Tertiary alcohols 1,2-diols Secondary alcohols Carboxylic acids Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
3-phenylpropanoic-acid - Methoxyphenol - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Beta-hydroxy acid - Phenol - Alpha-hydroxy acid - Benzenoid - Monosaccharide - Hydroxy acid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Tertiary alcohol - Secondary alcohol - 1,2-diol - Ether - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Alcohol - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic oxygen compound - 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