Compound Identification
SMILES
OC[C@@H](NC(=O)C1=C\C(C=N1)=C1/NNC=C1C1=CC(Cl)=C(CNC(=O)CCCCCNC2=CC=C(C3=NON=C23)[N+]([O-])=O)C=C1)C1=CC(Cl)=C(F)C=C1
InChIKey
InChIKey=USVDJUXUBZQGHH-PDQROTASSA-N
Formula
C35H32Cl2FN9O6
Mass
764.6
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
Alpha amino acids and derivatives
Alternative Parents
Benzoxadiazoles Nitroaromatic compounds Chlorobenzenes Fluorobenzenes Secondary alkylarylamines Aryl chlorides Aryl fluorides N-acyl amines Pyrazolines Furazans Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Hydrazines and derivatives Primary alcohols Organic salts Organic zwitterions Organochlorides Carbonyl compounds Hydrocarbon derivatives Imines Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Benzoxadiazole - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Benzenoid - Aryl halide - Fatty amide - Monocyclic benzene moiety - Fatty acyl - N-acyl-amine - Furazan - Azole - Pyrazoline - Oxadiazole - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Organic nitro compound - C-nitro compound - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxoazanium - Organonitrogen compound - Hydrazine derivative - Hydrocarbon derivative - Organic zwitterion - Organic oxide - Organic oxygen compound - Organic salt - Carbonyl group - Amine - Organic nitrogen compound - Imine - Primary alcohol - Organooxygen compound - Organohalogen compound - Alcohol - Organochloride - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available