Compound Identification
SMILES
CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CCC(=O)N[C@@H](CC([O-])=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=LPRLZLOXKRBFHM-INIZCTEOSA-M
Formula
C23H30N3O8
Mass
476.507
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
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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
Piperazine carboxylic acids Benzodioxoles Benzenoids N-acyl amines Tertiary carboxylic acid amides Carbamate esters Secondary carboxylic acid amides Carboxylic acid salts Acetals Azacyclic compounds Oxacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organonitrogen compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta amino acid or derivatives - Benzodioxole - Piperazine-1-carboxylic acid - 1,4-diazinane - Fatty amide - N-acyl-amine - Piperazine - Benzenoid - Fatty acyl - Carbamic acid ester - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Acetal - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic anion - 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