Compound Identification
SMILES
CCCC[C@@H](C(=O)N[C@@H](CC(O)=O)C1=CC2=C(OCO2)C=C1)C1=CC(C)=CN(CC2=CC=CC=C2)C1=O
InChIKey
InChIKey=VFQQPEQMHKVUSU-VWNXMTODSA-N
Formula
C29H32N2O6
Mass
504.583
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
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
Benzodioxoles Pyridinones Methylpyridines Dihydropyridines Benzene and substituted derivatives N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Lactams Oxacyclic compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Benzodioxole - Methylpyridine - Dihydropyridine - Pyridinone - Monocyclic benzene moiety - Fatty amide - Hydropyridine - Fatty acyl - Benzenoid - Pyridine - N-acyl-amine - Heteroaromatic compound - Carboxamide group - Lactam - Secondary carboxylic acid amide - Acetal - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic 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