Compound Identification
SMILES
CCC(C)(C)C(=O)NC(C1CCCCC1)C1=CC(C)=CC(C)=C1OCC(O)C[C@@H](O)CC(O)=O
InChIKey
InChIKey=XAFSODPXPFYGDP-UZGSZPBKSA-N
Formula
C27H43NO6
Mass
477.642
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Hydroxy acids and derivatives
Subclass
Medium-chain hydroxy acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Medium-chain hydroxy acids and derivatives
Alternative Parents
m-Xylenes Phenoxy compounds Phenol ethers Medium-chain fatty acids Alkyl aryl ethers Amino fatty acids Beta hydroxy acids and derivatives Hydroxy fatty acids Branched fatty acids N-acyl amines Secondary carboxylic acid amides Secondary alcohols Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Medium-chain hydroxy acid - Phenoxy compound - M-xylene - Xylene - Phenol ether - Medium-chain fatty acid - Alkyl aryl ether - Amino fatty acid - Beta-hydroxy acid - Branched fatty acid - Hydroxy fatty acid - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Fatty acid - N-acyl-amine - Benzenoid - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain.
External Descriptors
Not available