Compound Identification
SMILES
C[C@H](CC1=CC=C(O1)C(=O)OC1=C(F)C=C(C=C1)C(C)=N)C(=O)N[C@H](CC(O)=O)C(O)=O
InChIKey
InChIKey=YZPVZOHACHWOGB-MEBBXXQBSA-N
Formula
C21H21FN2O8
Mass
448.403
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Aspartic acid and derivatives
-
Level 6
Alpha amino acids and derivatives
-
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
Aspartic acid and derivatives
Alternative Parents
Acyl D-homoserines N-acyl-alpha amino acids Phenol esters Furoic acid esters Phenoxy compounds Fluorobenzenes Aryl fluorides Dicarboxylic acids and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Ketimines Carboxylic acid esters Oxacyclic compounds Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aspartic acid or derivatives - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Acyl-homoserine - Acyl-d-homoserine - Phenol ester - Furoic acid ester - Furoic acid or derivatives - Phenoxy compound - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Furan - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Ketimine - Oxacycle - Carboxylic acid - Organoheterocyclic compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organofluoride - Organohalogen compound - Imine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available