Compound Identification
SMILES
COC1=CC(NCCCOC2=CC=C(C[C@@H](CC(=O)NO)NS(=O)(=O)C3=CC=C(C)C=C3)C=C2)=NC=C1
InChIKey
InChIKey=FNEQKUNCUDEQIC-NRFANRHFSA-N
Formula
C26H32N4O6S
Mass
528.62
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Beta amino acids and derivatives
Alternative Parents
P-toluenesulfonamides Amphetamines and derivatives Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Phenol ethers Alkyl aryl ethers Aminopyridines and derivatives Organosulfonamides Imidolactams Aminosulfonyl compounds Heteroaromatic compounds Hydroxamic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Amines Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-toluenesulfonamide - Beta amino acid or derivatives - Amphetamine or derivatives - Benzenesulfonamide - Tosyl compound - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyridine - Toluene - Monocyclic benzene moiety - Pyridine - Organosulfonic acid amide - Imidolactam - Benzenoid - Sulfonyl - Heteroaromatic compound - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Hydroxamic acid - Azacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available