Compound Identification
SMILES
C[C@H]1OC(=O)C2CC3CNCCC3C(\C=C\C3=NC=C(C=C3)C3=CC(=CC=C3)C(F)(F)F)C12
InChIKey
InChIKey=RFSXOUSYMFLYNV-CIPUZSACSA-N
Formula
C26H27F3N2O2
Mass
456.509
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
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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
Delta amino acids and derivatives
Alternative Parents
Phenylpyridines Trifluoromethylbenzenes Piperidines Gamma butyrolactones Oxolanes Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Oxacyclic compounds Dialkylamines Monocarboxylic acids and derivatives Carbonyl compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Delta amino acid or derivatives - 3-phenylpyridine - Trifluoromethylbenzene - Monocyclic benzene moiety - Gamma butyrolactone - Benzenoid - Piperidine - Pyridine - Heteroaromatic compound - Oxolane - Carboxylic acid ester - Lactone - Secondary aliphatic amine - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Organohalogen compound - Amine - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 carbon atom.
External Descriptors
Not available