Compound Identification
SMILES
CC(C)COC(=O)COC1=CC=C(C[C@H](NC(=O)OC(C)(C)C)[C@H](O)CNC[C@@H](O)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C)C=C1
InChIKey
InChIKey=FGVCTMMVFNDTPP-SYQUUIDJSA-N
Formula
C36H55N3O9
Mass
673.848
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenoxyacetic acid derivatives
Alternative Parents
Phenylbutylamines Amphetamines and derivatives Phenoxy compounds Phenol ethers Aralkylamines Alkyl aryl ethers Carbamate esters Secondary alcohols Carboxylic acid esters 1,2-aminoalcohols Monocarboxylic acids and derivatives Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxyacetate - Phenylbutylamine - Amphetamine or derivatives - Phenol ether - Phenoxy compound - Alkyl aryl ether - Aralkylamine - Carbamic acid ester - Carboxylic acid ester - 1,2-aminoalcohol - Amino acid or derivatives - Secondary alcohol - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.
External Descriptors
Not available