Compound Identification
SMILES
CC[C@@H]1C[C@H](NC2=NC=C(N3CCOCC3)C(CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)=N2)C2=C(C=CC(=C2)C(F)(F)F)N1C(=O)O[C@@H]1C[C@H](N(C1)C(=O)OC(C)(C)C)C(=O)OC
InChIKey
InChIKey=NXKJMBHEZMUYET-GISMLAESSA-N
Formula
C41H45F9N6O7
Mass
904.832
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
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Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha 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 - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
Proline and derivatives Trifluoromethylbenzenes Hydroquinolines Pyrrolidine carboxylic acids Dialkylarylamines Aminopyrimidines and derivatives Morpholines Methyl esters Carbamate esters Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Proline or derivatives - Tetrahydroquinoline - Trifluoromethylbenzene - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aminopyrimidine - Morpholine - Oxazinane - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Pyrrolidine - Methyl ester - Carbamic acid ester - Heteroaromatic compound - Tertiary amine - Carboxylic acid ester - Dialkyl ether - Ether - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available