Compound Identification
SMILES
CC(C)(C)C1CCC(CC1)C(CC1=CC=C(C=C1)C(=O)NCCC(O)=O)C(=O)NC1=CC(=CC(=C1)C(F)(F)F)[N+]([O-])=O
InChIKey
InChIKey=CFAQPMKZPUOYIT-UHFFFAOYSA-N
Formula
C30H36F3N3O6
Mass
591.628
Taxonomic Classification
Taxonomy Tree
-
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
- 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
Trifluoromethylbenzenes Aromatic monoterpenoids Menthane monoterpenoids Monocyclic monoterpenoids Anilides Benzamides Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds N-arylamides Fatty amides Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxoazanium compounds Monocarboxylic acids and derivatives Alkyl fluorides Carbonyl compounds Organic salts Organofluorides Hydrocarbon derivatives Organic oxides Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - Monoterpenoid - P-menthane monoterpenoid - Monocyclic monoterpenoid - Aromatic monoterpenoid - Trifluoromethylbenzene - Anilide - Nitrobenzene - Benzoic acid or derivatives - Benzamide - Benzoyl - N-arylamide - Nitroaromatic compound - Fatty acyl - Fatty amide - Benzenoid - Monocyclic benzene moiety - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Carbonyl group - Alkyl fluoride - Organic salt - Hydrocarbon derivative - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Aromatic homomonocyclic 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