Compound Identification
SMILES
CC(C)C1=CC=CC=C1C1=NO[C@](C1)(C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)CF
InChIKey
InChIKey=YQVBCGCMEXUBAL-HRAATJIYSA-N
Formula
C21H27FN2O5
Mass
406.454
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
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
-
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
Phenylpropanes Cumenes Gamma-keto acids and derivatives Fatty amides Alpha-haloketones Isoxazolines Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Organopnictogen compounds Aldehydes Organofluorides Hydrocarbon derivatives Organic oxides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - Cumene - Phenylpropane - Gamma-keto acid - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Keto acid - Benzenoid - Alpha-haloketone - Isoxazoline - Carboxamide group - Secondary carboxylic acid amide - Ketone - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Aldehyde - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen 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